SCHEMBL14989335

SCHEMBL14989335

Cc1ccsc1OC(=O)Nc1cc(CN2CC[C@@H](O)C2)ccc1/C=C/c1n[nH]c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 6/20 0.54
▸ AURKB Q96GD4 5/20 0.54
▸ PARP1 P09874 2/20 0.36
▸ MCHR1 Q99705 4/20 0.34
▸ KCNH2 Q12809 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ S1PR1 P21453 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ FLT1 P17948 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ ACKR3 P25106 1/20 0.33
▸ PDE2A O00408 1/20 0.33
▸ PDCD1 Q15116 1/20 0.33
▸ CD274 Q9NZQ7 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
SCHEMBL14988993 0.93 AURKA (0.54) AURKAAURKBMCHR1KCNH2HDAC1
SCHEMBL14989359 0.93 AURKA (0.53) AURKAAURKBMCHR1KCNH2HDAC1
SCHEMBL14989064 0.91 AURKA (0.54) AURKAAURKBKCNH2HDAC1
SCHEMBL14989042 0.90 AURKA (0.59) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989132 0.90 AURKA (0.56) AURKAAURKBPARP1CDK5CDK5R1
SCHEMBL14989189 0.89 AURKA (0.57) AURKAAURKBMCHR1CDK5CDK5R1
SCHEMBL14989222 0.89 AURKA (0.57) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989004 0.88 AURKA (0.58) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL4316062 0.88 AURKA (0.67) AURKAAURKBPARP1CDK5CDK5R1
SCHEMBL4316067 0.88 AURKA (0.67) AURKAAURKBPARP1CDK5CDK5R1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1847532-B1 IGF-1R INHIBITOR KYOWA HAKKO KIRIN CO LTD (JP) 2013-06-05 — — EP claimed
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