SCHEMBL6744080

SCHEMBL6744080

Cc1cccc(CC2C(=O)Nc3cccc(CCO)c32)n1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.33
MAPT P10636 2/20 0.33
HSD17B3 P37058 1/20 0.33
TP53 P04637 1/20 0.33
MMP12 P39900 1/20 0.32
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 3/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CREBBP Q92793 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NR3C1 P04150 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.30
GSK3B P49841 1/20 0.30

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
SCHEMBL6746665 0.78 GSK3B (0.44) MAPTALDH1A1KDM4ECREBBPGSK3B
SCHEMBL6745220 0.75 GSK3B (0.41) POLBMAPTTP53KDM4ELMNA
SCHEMBL1632272 0.67 SMN1; SMN2 (0.45) HSD17B3ALDH1A1KDM4ESMN1; SMN2MEN1
SCHEMBL30392101 0.67 SMN1; SMN2 (0.45) HSD17B3ALDH1A1KDM4ESMN1; SMN2MEN1
SCHEMBL6740554 0.63 CDK2 (0.50) ALDH1A1MEN1KMT2AGSK3B
SCHEMBL6740553 0.63 CDK2 (0.50) ALDH1A1MEN1KMT2AGSK3B
SCHEMBL5894137 0.61 CREBBP (0.33) POLBMAPTALDH1A1KDM4EHSD17B10
SCHEMBL24186364 0.61 KDM1A (0.43) MAPTSMN1; SMN2MEN1KMT2ANR3C1
SCHEMBL4314841 0.61 KCNH2 (0.47) HSD17B3SMN1; SMN2MEN1KMT2A
SCHEMBL116463 0.60

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