SCHEMBL1780795

SCHEMBL1780795

CC(=O)Nc1ccccc1C(=O)Nc1n[nH]c2sc(C(=O)NC(C)(C)c3ccccc3)cc12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.45
ABL1 P00519 2/20 0.43
BCR P11274 2/20 0.43
RXFP1 Q9HBX9 2/20 0.42
FGFR4 P22455 6/20 0.38
BDKRB1 P46663 1/20 0.38
TACR3 P29371 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NR1H4 Q96RI1 5/20 0.36
PPARG P37231 5/20 0.36
POLB P06746 1/20 0.36
CYP2C19 P33261 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL1779700 0.92 AURKA (0.50) AURKAABL1BCRRXFP1NPSR1
SCHEMBL1779328 0.91 RXFP1 (0.44) AURKAABL1BCRRXFP1FGFR4
SCHEMBL1779573 0.90 AURKA (0.43) AURKAABL1BCRRXFP1FGFR4
SCHEMBL1778129 0.90 AURKA (0.43) AURKAABL1BCRRXFP1FGFR4
SCHEMBL1779010 0.88 RXFP1 (0.48) AURKAABL1BCRRXFP1FGFR4
SCHEMBL1780912 0.88 AURKA (0.49) AURKAABL1BCRRXFP1NR1H4
SCHEMBL1780888 0.88 RXFP1 (0.46) AURKAABL1BCRRXFP1FGFR4
SCHEMBL1778942 0.88 RXFP1 (0.38) AURKARXFP1FGFR4BDKRB1NR1H4
SCHEMBL1777886 0.88 AURKA (0.41) AURKAABL1BCRFGFR4NPSR1
SCHEMBL1779104 0.88 AURKA (0.43) AURKAABL1BCRFGFR4BDKRB1

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
US-7943654-B2 1H-thieno[2,3-c]pyrazole compounds useful as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-05-17 US disclosed