SCHEMBL6614689

SCHEMBL6614689

CCNC(=O)n1nc(-c2ccc(NC(=O)c3ccno3)cc2O)cc1C1CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.44
▸ KDM4C Q9H3R0 1/20 0.42
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ HTR2A P28223 1/20 0.40
▸ BACE1 P56817 1/20 0.39
▸ HTT P42858 2/20 0.37
▸ ACKR3 P25106 1/20 0.37
▸ CRACR2A Q9BSW2 4/20 0.36
▸ PARP1 P09874 1/20 0.35
▸ HSD11B1 P28845 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ RXFP2 Q8WXD0 1/20 0.35
▸ RXFP1 Q9HBX9 1/20 0.35
▸ RORC P51449 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
SCHEMBL6618457 0.93 MAPK14 (0.43) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6615451 0.89 MAPK14 (0.43) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6616464 0.89 KDM4C (0.42) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6617014 0.89 KDM4C (0.41) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6617873 0.88 MAPK14 (0.40) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6617028 0.88 KDM4C (0.42) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6614939 0.87 KDM4C (0.41) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6618817 0.87 MAPK14 (0.43) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6615529 0.87 MAPK14 (0.41) MAPK14KDM4CKMT2AMEN1HTR2A
SCHEMBL6618222 0.86 RAB9A (0.43) MAPK14KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP claimed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO claimed
EP-1458379-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2004-09-22 — — EP disclosed
WO-2003051358-A1 HYDROXYPHENYL-PYRAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA SPA (IT) 2003-06-26 — — WO disclosed
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