SCHEMBL14989189

SCHEMBL14989189

Cc1ccsc1OC(=O)Nc1cc(CN2CCC(S(C)(=O)=O)CC2)ccc1/C=C/c1n[nH]c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 6/20 0.57
▸ AURKB Q96GD4 5/20 0.57
▸ CDK5 Q00535 1/20 0.34
▸ CDK5R1 Q15078 1/20 0.34
▸ FGFR1 P11362 1/20 0.34
▸ FLT1 P17948 1/20 0.34
▸ ACKR3 P25106 1/20 0.34
▸ GSK3B P49841 2/20 0.33
▸ MCHR1 Q99705 2/20 0.33
▸ MAPK8 P45983 1/20 0.33
▸ MAPK9 P45984 1/20 0.33
▸ MAPK10 P53779 1/20 0.33
▸ CHEK1 O14757 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ MAP4K4 O95819 1/20 0.32
▸ NTRK1 P04629 1/20 0.32
▸ FLT3 P36888 1/20 0.32
▸ BCHE P06276 1/20 0.32
▸ ACHE P22303 1/20 0.32
▸ LTA4H P09960 1/20 0.32

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
SCHEMBL14988946 0.91 AURKA (0.59) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14988993 0.91 AURKA (0.54) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989042 0.90 AURKA (0.59) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989132 0.90 AURKA (0.56) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989335 0.89 AURKA (0.54) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989222 0.89 AURKA (0.57) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989359 0.89 AURKA (0.53) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL4311822 0.89 AURKA (0.72) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL4311817 0.89 AURKA (0.72) AURKAAURKBCDK5CDK5R1FGFR1
SCHEMBL14989004 0.88 AURKA (0.58) AURKAAURKBCDK5CDK5R1FGFR1

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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