SCHEMBL6617014

SCHEMBL6617014

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

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4C Q9H3R0 1/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HTR2A P28223 1/20 0.37
▸ ACKR3 P25106 1/20 0.36
▸ CRACR2A Q9BSW2 5/20 0.35
▸ MAPK10 P53779 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ HSD11B1 P28845 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ RORC P51449 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33

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
SCHEMBL6614689 0.89 MAPK14 (0.44) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6618457 0.87 MAPK14 (0.43) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6616464 0.86 KDM4C (0.42) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6621868 0.86 PKM (0.44) MAPK14KMT2AMEN1
SCHEMBL6617873 0.86 MAPK14 (0.40) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6615451 0.85 MAPK14 (0.43) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6614939 0.85 KDM4C (0.41) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6617028 0.83 KDM4C (0.42) KDM4CMAPK14KMT2AMEN1HTR2A
SCHEMBL6615863 0.83 RAB9A (0.40) KMT2AMEN1CRACR2A
SCHEMBL6615391 0.83 KMT2A (0.40) KDM4CMAPK14KMT2AMEN1HTR2A

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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