SCHEMBL62930

SCHEMBL62930

COC(=O)c1ccc(NC(=O)c2ccccc2)cc1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.90
RAB9A P51151 7/20 0.73
NPC1 O15118 6/20 0.73
SMN1; SMN2 Q16637 5/20 0.73
ALDH1A1 P00352 3/20 0.73
LMNA P02545 1/20 0.73
HTT P42858 1/20 0.73
ATM Q13315 1/20 0.73
GAA P10253 2/20 0.71
MEN1 O00255 5/20 0.70
KMT2A Q03164 5/20 0.70
MAPT P10636 1/20 0.70
CACNA1B Q00975 2/20 0.69
APBA1 Q02410 2/20 0.69
TSHR P16473 1/20 0.68
POLB P06746 2/20 0.68
KDM4E B2RXH2 1/20 0.68
PKM P14618 2/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
TP53 P04637 1/20 0.68

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
SCHEMBL2835923 0.95 PTPN1 (0.81) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL6263820 0.93 NPC1 (0.83) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL8660366 0.93 NPC1 (0.83) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL2835618 0.92 PTPN1 (0.94) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL29611669 0.92 PTPN1 (0.94) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL22223650 0.92 PTPN1 (0.94) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL2834528 0.89 PTPN1 (0.73) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL18103163 0.87 NPC1 (0.88) PTPN1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL14715824 0.87 NPC1 (0.88) PTPN1RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL4609805 0.86 NPC1 (0.79) PTPN1RAB9ANPC1SMN1; SMN2ALDH1A1

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049388-B1 NUCLEATING AGENT FOR THERMOPLASTIC POLYMER COMPOSITION MILLIKEN & CO (US) 2019-08-07 EP disclosed
EP-2850068-B1 N-(phenyl)-2-[[3-(phenyl)-1H-1,2,4-triazol-5-yl]thio]-acetamide derivatives and related compounds as G protein coupled receptor 17 (GPCR17) modulators for use in the treatment of neuro-degenerative diseases UNIV DEGLI STUDI MILANO (IT) 2019-05-29 EP disclosed
US-10301267-B2 Compounds ASTRAZENECA AB (SE) 2019-05-28 US disclosed
US-9879030-B2 GPR17 receptor modulators UNIVERSITA′ DEGLI STUDI DI MILANO (IT) 2018-01-30 US disclosed
US-9879030-B2 GPR17 receptor modulators UNIVERSITA′ DEGLI STUDI DI MILANO (IT) 2018-01-30 US disclosed
US-9856252-B2 2-(hetero)aryl-benzimidazole and imidazopyridine derivatives as inhibitors of asparagime emethyl transferase CANCER THERAPEUTICS CRC PTY LTD (AU) 2018-01-02 US disclosed
US-9856252-B2 2-(hetero)aryl-benzimidazole and imidazopyridine derivatives as inhibitors of asparagime emethyl transferase CANCER THERAPEUTICS CRC PTY LTD (AU) 2018-01-02 US disclosed
US-20170260143-A1 NOVEL COMPOUNDS ASTRAZENECA AB (SE) 2017-09-14 US disclosed
US-9688640-B2 Methods of treating cancer with a pyrazole derivative ASTRAZENECA AB (SE) 2017-06-27 US disclosed
US-20160222005-A1 2-(HETERO)ARYL-BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AS INHIBITORS OF ASPARAGIME EMETHYL TRANSFERASE CANCER THERAPEUTICS CRC PTY LTD (AU) 2016-08-04 US disclosed
EP-1660437-B1 HYDROXAMIC ACID DERIVATIVES AND THE METHOD FOR PREPARING THEREOF AMOREPACIFIC CORP (KR) 2008-10-15 EP disclosed
US-20080153812-A1 Heterocyclic amides as anticancer agents ASTRAZENECA AB (SE) 2008-06-26 US disclosed
WO-2008075068-A2 ACYLAMINOPYRAZOLES AS FGFR INHIBITORS ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 WO disclosed
WO-2007138033-A1 2-PHENYL-5-AMINO-1,3,4-OXADIAZOLES AND THEIR USE AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2007-12-06 WO disclosed
US-7282522-B2 Hydroxamic acid derivatives and the method for preparing thereof AMOREPACIFIC CORPORATION (KR) 2007-10-16 US disclosed
US-20060252834-A1 Hydroxamic acid derivatives and the method for preparing thereof AMOREPACIFIC CORPORATION (KR) 2006-11-09 US disclosed
EP-1660437-A4 HYDROXAMIC ACID DERIVATIVES AND THE METHOD FOR PREPARING THEREOF AMOREPACIFIC CORP (KR) 2006-09-20 EP disclosed
EP-1660437-A1 HYDROXAMIC ACID DERIVATIVES AND THE METHOD FOR PREPARING THEREOF Amorepacific Corporation (KR) 2006-05-31 EP disclosed
WO-2005019162-A1 HYDROXAMIC ACID DERIVATIVES AND THE METHOD FOR PREPARING THEREOF AMOREPACIFIC CORPORATION (KR) 2005-03-03 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 (5 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-10301267-B2 Compounds SLC10A1, CYP11B1, ABCB11 PTPN1 3023/4885RAB9A 1091/4885NPC1 52/4885
US-20160222005-A1 2-(HETERO)ARYL-BENZIMIDAZOLE AND IMIDAZOPYRIDINE DERIVATIVES AS INHIBITORS OF ASPARAGIME EMETHYL TRANSFERASE B2M, HBG2, BCAT2 PTPN1 3551/4885RAB9A 3598/4885NPC1 3511/4885
US-20060252834-A1 Hydroxamic acid derivatives and the method for preparing thereof HDAC7, SIRT7, HCAR1 PTPN1 4406/4885RAB9A 4487/4885NPC1 2347/4885
US-20080153812-A1 Heterocyclic amides as anticancer agents HDAC1, HDAC11, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 PTPN1 3967/4885RAB9A 903/4885NPC1 608/4885
US-20170260143-A1 NOVEL COMPOUNDS SLC10A1, ABCB11, CYP11B1 PTPN1 3817/4885RAB9A 701/4885NPC1 20/4885

“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.