SCHEMBL3307757

SCHEMBL3307757

Clc1cc2nccnc2cc1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.41
CSNK2A1 P68400 2/20 0.37
CASP6 P55212 1/20 0.35
MAPK13 O15264 1/20 0.33
CDK1 P06493 1/20 0.33
PIM1 P11309 1/20 0.33
DYRK1A Q13627 1/20 0.33
PIM3 Q86V86 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
NPC1 O15118 3/20 0.31
RAB9A P51151 3/20 0.31
HCAR1 Q9BXC0 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTT P42858 1/20 0.30
NR4A2 P43354 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL29639045 0.81 HTT (0.36) AHRCSNK2A1CDK1NPC1RAB9A
SCHEMBL1258350 0.81 CDK1 (0.48) AHRCASP6MAPK13CDK1PIM1
SCHEMBL18388861 0.81 HTT (0.36) AHRCSNK2A1CDK1NPC1RAB9A
SCHEMBL16636981 0.76 PRKCI (0.41) AHRCSNK2A1CYP1A2HTTNR4A2
SCHEMBL28370443 0.74 CASP6 (0.62) CASP6MMP2NPC1RAB9ACYP1A2
SCHEMBL22659050 0.74 CASP6 (0.58) CASP6MMP2NPC1RAB9ACYP1A2
SCHEMBL2594620 0.73 AHR (0.44) AHRCSNK2A1MAPK13CDK1PIM1
SCHEMBL21050938 0.72 KMT2A (0.39) CYP1A2HTTNR4A2MEN1POLB
SCHEMBL28995880 0.72 SMN1; SMN2 (0.41) NPC1RAB9AHCAR1CYP1A2HTT
SCHEMBL18451242 0.72 KMT2A (0.39) CSNK2A1CYP1A2HTTNR4A2MEN1

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250101436-A1 APTAMERS AND SMALL MOLECULE LIGANDS MeiraGTx Gene Regulation Limited (GB) 2025-03-27 US disclosed
EP-4448769-A2 APTAMERS AND SMALL MOLECULE LIGANDS Meiragtx UK II Limited (GB) 2024-10-23 EP disclosed
CN-118786217-A Aptamer and small molecule ligand 梅里特斯英国第二有限公司 2024-10-15 CN disclosed
WO-2023111686-A2 APTAMERS AND SMALL MOLECULE LIGANDS MEIRAGTX UK II LIMITED (GB) 2023-06-22 WO disclosed
WO-2023111686-A2 APTAMERS AND SMALL MOLECULE LIGANDS MEIRAGTX UK II LIMITED (GB) 2023-06-22 WO disclosed
CN-102197031-A Substituted 5-aminopyrazoles and use thereof BAYER SCHERING PHARMA AG 2011-09-21 CN disclosed
US-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-22 US disclosed
US-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-22 US disclosed
US-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-04-22 US disclosed
WO-2010020363-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-02-25 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 (2 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-20250101436-A1 APTAMERS AND SMALL MOLECULE LIGANDS RNGTT, SLIRP, SNRPE AHR 2544/4885CSNK2A1 4186/4885CASP6 2710/4885
US-20100099681-A1 SUBSTITUTED 5-AMINOPYRAZOLES AND USE THEREOF CYP3A5, ABAT, TPMT AHR 617/4885CSNK2A1 3313/4885CASP6 1192/4885

“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.