Limantrafin

Limantrafin

SCHEMBL21597014

CC(C)(C)c1ccc(Oc2ccc(N)cn2)cc1.Cl

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Limantrafin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.97
RAB9A P51151 5/20 0.97
POLB P06746 3/20 0.97
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
MAPT P10636 7/20 0.61
ALDH1A1 P00352 4/20 0.61
MAPK1 P28482 3/20 0.61
NPC1 O15118 2/20 0.61
HPGD P15428 1/20 0.61
BRCA1 P38398 1/20 0.51
HBB P68871 1/20 0.51
HSD17B10 Q99714 1/20 0.51
GFER P55789 1/20 0.46
PKM P14618 1/20 0.46
NPSR1 Q6W5P4 2/20 0.45
HTT P42858 1/20 0.45
KEAP1 Q14145 1/20 0.44
LMNA P02545 1/20 0.42
GALR3 O60755 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Limantrafin SCHEMBL30617842 1.00 KDM4E (0.97) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL25340427 0.98 KDM4E (1.00) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL4638726 0.98 KDM4E (1.00) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL30865022 0.97 KDM4E (0.97) KDM4ERAB9APOLBMEN1KMT2A
Limantrafin SCHEMBL29221528 0.97 KDM4E (0.97) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL28064235 0.89 KDM4E (0.82) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL30601045 0.89 KDM4E (0.82) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL28055507 0.89 KDM4E (0.82) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL31225411 0.83 KDM4E (0.73) KDM4ERAB9APOLBMEN1KMT2A
SCHEMBL15055437 0.83 KDM4E (0.73) KDM4ERAB9APOLBMEN1KMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240254084-A9 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2024-08-01 US claimed
US-20230338347-A1 New Use of Inhibitors of the Notch Signalling Pathway CELLESTIA BIOTECH AG (CH) 2023-10-26 US claimed
EP-4213845-A1 NEW USE OF INHIBITORS OF THE NOTCH SIGNALLING PATHWAY Cellestia Biotech AG (CH) 2023-07-26 EP claimed
US-20220388961-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2022-12-08 US claimed
US-20210323921-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2021-10-21 US claimed
CN-112351969-A Process for preparing aminodiaryl ethers and aminodiaryl ether hydrochlorides 塞莱斯蒂亚生物技术股份公司 2021-02-09 CN claimed
US-20240254084-A9 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2024-08-01 US disclosed
US-12030855-B2 Process for making amino diaryl ethers and amino diaryl ethers hydrochloride salts CELLESTIA BIOTECH AG (CH) 2024-07-09 US disclosed
US-20230338347-A1 New Use of Inhibitors of the Notch Signalling Pathway CELLESTIA BIOTECH AG (CH) 2023-10-26 US disclosed
EP-4213845-A1 NEW USE OF INHIBITORS OF THE NOTCH SIGNALLING PATHWAY Cellestia Biotech AG (CH) 2023-07-26 EP disclosed
US-20220388961-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2022-12-08 US disclosed
US-11472771-B2 Process for making amino diaryl ethers and amino diaryl ethers hydrochloride salts CELLESTIA BIOTECH AG (CH) 2022-10-18 US disclosed
US-20210323921-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2021-10-21 US disclosed
EP-3810574-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS Cellestia Biotech AG (CH) 2021-04-28 EP disclosed
CN-112351969-A Process for preparing aminodiaryl ethers and aminodiaryl ether hydrochlorides 塞莱斯蒂亚生物技术股份公司 2021-02-09 CN disclosed
WO-2019243523-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS CELLESTIA BIOTECH AG (CH) 2019-12-26 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240254084-A9 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS ADH1C, ADH1A, DDC KDM4E 499/4885RAB9A 932/4885POLB 2056/4885
US-11472771-B2 Process for making amino diaryl ethers and amino diaryl ethers hydrochloride salts ADH1C, ADH1A, DDC KDM4E 499/4885RAB9A 932/4885POLB 2056/4885
US-20210323921-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS ADH1C, ADH1A, DDC KDM4E 499/4885RAB9A 932/4885POLB 2056/4885
US-20230338347-A1 New Use of Inhibitors of the Notch Signalling Pathway NOTCH1, NOTCH2, NOTCH4 KDM4E 892/4885RAB9A 3556/4885POLB 3352/4885
US-20220388961-A1 PROCESS FOR MAKING AMINO DIARYL ETHERS AND AMINO DIARYL ETHERS HYDROCHLORIDE SALTS ADH1C, ADH1A, DDC KDM4E 499/4885RAB9A 932/4885POLB 2056/4885
US-12030855-B2 Process for making amino diaryl ethers and amino diaryl ethers hydrochloride salts ADH1C, ADH1A, DDC KDM4E 499/4885RAB9A 932/4885POLB 2056/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.