SCHEMBL8324249

SCHEMBL8324249

CC(C)(C)c1cc(C=C2C(=O)Nc3ncccc32)cc(C(C)(C)C)c1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 1.00
ERBB2 P04626 3/20 0.67
EGFR P00533 2/20 0.67
IGF1R P08069 1/20 0.67
APP P05067 2/20 0.57
MAPT P10636 2/20 0.57
SNCA P37840 2/20 0.57
EEF2K O00418 1/20 0.49
SRC P12931 1/20 0.49
GAA P10253 1/20 0.48
RAF1 P04049 1/20 0.47
NTRK1 P04629 1/20 0.47
PTGS2 P35354 4/20 0.46
PTGS1 P23219 3/20 0.46
SIRT1 Q96EB6 1/20 0.46

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
SCHEMBL27463151 0.84 CTRC (0.72) CTRCERBB2EGFRIGF1RAPP
SCHEMBL12537627 0.81 CTRC (0.69) CTRCEGFRAPPMAPTSNCA
SCHEMBL12694955 0.81 CTRC (0.69) CTRCERBB2EGFRIGF1RAPP
SCHEMBL12537625 0.81 CTRC (0.69) CTRCEGFRAPPMAPTSNCA
SCHEMBL5472251 0.80 ERBB2 (1.00) CTRCERBB2EGFRIGF1RAPP
SCHEMBL5472252 0.80 ERBB2 (1.00) CTRCERBB2EGFRIGF1RAPP
SCHEMBL8325317 0.78 MAPT (0.70) CTRCAPPMAPTSNCARAF1
SCHEMBL12537515 0.77 CTRC (0.62) CTRCAPPMAPTSNCAGAA
SCHEMBL12537513 0.77 CTRC (0.62) CTRCAPPMAPTSNCAGAA
SCHEMBL7318433 0.77 ERBB2 (0.68) CTRCERBB2EGFRIGF1RMAPT

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 8 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
CN-1139929-A Substituted 3-arylene-7-azaoxindole compounds and methods for their preparation PHARMACIA SPA (IT) 1997-01-08 CN 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