SCHEMBL6744829

SCHEMBL6744829

COc1ccc(/C(=C2\C(=O)Nc3ccccc32)c2[nH]c(C)cc2C)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.73
▸ RET P07949 3/20 0.45
▸ MAPT P10636 5/20 0.44
▸ GAA P10253 2/20 0.44
▸ ALDH1A1 P00352 2/20 0.44
▸ TTR P02766 1/20 0.44
▸ LRRK2 Q5S007 1/20 0.44
▸ CSNK1D P48730 4/20 0.44
▸ KDR P35968 3/20 0.44
▸ MAPK1 P28482 3/20 0.44
▸ CSNK1A1 P48729 3/20 0.44
▸ CSF1R P07333 2/20 0.44
▸ FGFR1 P11362 2/20 0.44
▸ SRC P12931 2/20 0.44
▸ FLT1 P17948 2/20 0.44
▸ FGFR3 P22607 2/20 0.44
▸ FLT4 P35916 2/20 0.44
▸ FLT3 P36888 2/20 0.44
▸ ALK Q9UM73 2/20 0.44
▸ AURKB Q96GD4 2/20 0.44

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
SCHEMBL6744832 1.00 TDP1 (0.73) TDP1RETMAPTGAAALDH1A1
SCHEMBL6742976 0.87 TDP1 (0.54) TDP1RETMAPTGAAALDH1A1
SCHEMBL6742981 0.87 TDP1 (0.54) TDP1RETMAPTGAAALDH1A1
SCHEMBL725960 0.85 TDP1 (1.00) TDP1MAPTGAAALDH1A1TTR
SCHEMBL29670839 0.85 TDP1 (1.00) TDP1MAPTGAAALDH1A1TTR
SCHEMBL2825850 0.75 TDP1 (0.75) TDP1MAPTGAAALDH1A1TTR
SCHEMBL13207340 0.75 TDP1 (0.75) TDP1MAPTGAAALDH1A1TTR
SCHEMBL2825852 0.75 TDP1 (0.75) TDP1MAPTGAAALDH1A1TTR
SCHEMBL6406357 0.75 TDP1 (0.75) TDP1MAPTGAAALDH1A1TTR
SCHEMBL5469189 0.75 KDR (0.48) TDP1RETMAPTALDH1A1LRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689806-B1 MODULATING PROTEIN KINASES AND RELATED SIGNAL TRANSDUCTION PATHWAYS SUGEN, INC. 2004-02-10 — — US disclosed
EP-1165513-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS Sugen, Inc. (US) 2002-01-02 — — EP disclosed
WO-2000056709-A1 INDOLINONE COMPOUNDS AS KINASE INHIBITORS SUGEN, INC. (US) 2000-09-28 — — WO disclosed
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