SCHEMBL8320786

SCHEMBL8320786

NC(=O)Nc1ccc2[nH]cc(C=C3C(=O)Nc4ncccc43)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 2/20 0.47
CHEK1 O14757 1/20 0.46
AKT2 P31751 7/20 0.45
PDPK1 O15530 3/20 0.45
NTRK1 P04629 6/20 0.45
CTRC Q99895 1/20 0.45
RAF1 P04049 1/20 0.45
PAK1 Q13153 2/20 0.44
PRKD3 O94806 2/20 0.43
ABL1 P00519 2/20 0.43
RET P07949 2/20 0.43
PDGFRB P09619 2/20 0.43
LTK P29376 2/20 0.43
KDR P35968 2/20 0.43
FLT3 P36888 2/20 0.43
CSNK1A1 P48729 2/20 0.43
CDK7 P50613 2/20 0.43
MAP2K1 Q02750 2/20 0.43
MST1R Q04912 2/20 0.43
NTRK3 Q16288 2/20 0.43

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
SCHEMBL8321898 0.91 CHEK1 (0.45) PDK1CHEK1AKT2PDPK1NTRK1
SCHEMBL8459438 0.86 PAK1 (0.42) PDK1CHEK1NTRK1CTRCRAF1
SCHEMBL8586376 0.84 NTRK1 (0.63) PDK1CHEK1AKT2PDPK1NTRK1
SCHEMBL8586372 0.84 NTRK1 (0.63) PDK1CHEK1AKT2PDPK1NTRK1
SCHEMBL8322768 0.83 NTRK1 (0.47) CHEK1PDPK1NTRK1CTRCRAF1
SCHEMBL8322159 0.83 NTRK1 (0.55) CHEK1NTRK1CTRCRAF1PRKD3
SCHEMBL8323351 0.83 NTRK1 (0.50) CHEK1PDPK1NTRK1CTRCRAF1
SCHEMBL8321858 0.82 NTRK1 (0.46) CHEK1NTRK1CTRCRAF1PRKD3
SCHEMBL8321792 0.82 PAK1 (0.69) PAK1MAPK1MAPT
SCHEMBL8319989 0.82 NTRK1 (0.47) CHEK1PDPK1NTRK1CTRCRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741726-B1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-11-17 EP claimed
EP-0741726-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1996-11-13 EP claimed
WO-1996016964-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A (IT) 1996-06-06 WO claimed
EP-0741726-B1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN SPA (IT) 1999-11-17 EP disclosed
US-5719135-A TYROSINE KINASE INHIBITORS PHARMACIA S.P.A. (IT) 1998-02-17 US disclosed
EP-0741726-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.p.A. (IT) 1996-11-13 EP disclosed
WO-1996016964-A1 SUBSTITUTED 3-ARYLIDENE-7-AZAOXINDOLE COMPOUNDS AND PROCESS FOR THEIR PREPARATION PHARMACIA & UPJOHN S.P.A (IT) 1996-06-06 WO disclosed