SCHEMBL6615529

SCHEMBL6615529

Cc1cccc(CNC(=O)n2nc(-c3ccc(NC(=O)c4ccno4)cc3O)cc2C2CC2)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.41
▸ ACKR3 P25106 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ F10 P00742 1/20 0.37
▸ ROCK2 O75116 2/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ CRACR2A Q9BSW2 1/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ NAMPT P43490 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ F2RL1 P55085 2/20 0.35
▸ KDR P35968 1/20 0.35
▸ ASAH1 Q13510 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
SCHEMBL6616798 0.95 KDM4C (0.44) MAPK14ACKR3KDM4CKMT2AF10
SCHEMBL6615451 0.91 MAPK14 (0.43) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6616464 0.91 KDM4C (0.42) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6618817 0.88 MAPK14 (0.43) MAPK14ACKR3KDM4CKMT2AROCK2
SCHEMBL6617873 0.87 MAPK14 (0.40) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6614689 0.87 MAPK14 (0.44) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6615668 0.86 KDM4C (0.49) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6618457 0.85 MAPK14 (0.43) MAPK14ACKR3KDM4CKMT2AHTR2A
SCHEMBL6616244 0.85 NAMPT (0.41) ACKR3KMT2AROCK2MEN1NAMPT
SCHEMBL6614939 0.85 KDM4C (0.41) MAPK14ACKR3KDM4CKMT2AROCK2

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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