SCHEMBL17604563

SCHEMBL17604563

NC(=O)c1ccnc(-c2c[nH]c(Cc3cccc(Cl)c3Cl)n2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM5B Q9UGL1 2/20 0.41
▸ KDM4B O94953 1/20 0.41
▸ KDM5C P41229 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.39
▸ PKM P14618 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KDM4C Q9H3R0 2/20 0.38
▸ KDM5A P29375 1/20 0.38
▸ PHF8 Q9UPP1 1/20 0.38
▸ TTK P33981 1/20 0.37
▸ MAP2K4 P45985 1/20 0.37
▸ PRKD1 Q15139 1/20 0.36
▸ PRKD2 Q9BZL6 1/20 0.36
▸ PRKCI P41743 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ HTR1A P08908 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ HTR2A P28223 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CD38 P28907 1/20 0.35

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
SCHEMBL16094975 0.91 KDM4C (0.43) KDM5BKDM4BKDM5CALDH1A1KDM4C
SCHEMBL16095379 0.84 KDM4C (0.47) KDM5BKDM4BKDM5CKDM4CKDM5A
SCHEMBL16095166 0.82 PARP1 (0.45) KDM5BKDM4BKDM5CKDM4CPRKD1
SCHEMBL17604506 0.81 KDM4C (0.54) KDM5BKDM4BKDM5CKDM4CKDM5A
SCHEMBL17604574 0.81 PHF8 (0.37) KDM4CPHF8MEN1KMT2A
SCHEMBL16095181 0.80 KDM5B (0.44) KDM5BKDM4BKDM5CKDM4CPARP1
SCHEMBL17604542 0.79 PHF8 (0.39) KDM4CPHF8MEN1KMT2APIM1
SCHEMBL16095813 0.78 PHF8 (0.39) L3MBTL1KDM4CPHF8POLB
SCHEMBL16095163 0.76 KDM4C (0.62) KDM5BKDM4CKDM5APHF8
SCHEMBL17604562 0.74 PHF8 (0.60) KDM5BKDM4CKDM5APHF8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3193881-A1 HISTONE DEMETHYLASE INHIBITORS Celgene Quanticel Research, Inc. (US) 2017-07-26 — — EP disclosed
WO-2016044342-A1 HISTONE DEMETHYLASE INHIBITORS Quanticel Pharmaceuticals, Inc. (US) 2016-03-24 — — WO disclosed
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