SCHEMBL7476948

SCHEMBL7476948

CCOC(=O)CCc1c(C(=O)OCC)[nH]c(CC=C2C(=O)Nc3ccccc32)c1CC(=O)OCC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 5/20 0.51
PDGFRB P09619 5/20 0.46
KDR P35968 4/20 0.46
FGFR1 P11362 4/20 0.46
RET P07949 3/20 0.46
FLT3 P36888 3/20 0.46
ALK Q9UM73 2/20 0.46
ABL1 P00519 1/20 0.46
FLT1 P17948 3/20 0.42
AURKB Q96GD4 3/20 0.42
MAP4K2 Q12851 2/20 0.42
STK3 Q13188 2/20 0.42
GAK O14976 1/20 0.42
RPS6KA5 O75582 1/20 0.42
RPS6KA4 O75676 1/20 0.42
LATS1 O95835 1/20 0.42
CSNK2A2 P19784 1/20 0.42
MAP2K2 P36507 1/20 0.42
ZAP70 P43403 1/20 0.42
MAP2K1 Q02750 1/20 0.42

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
SCHEMBL7476554 0.96 AURKA (0.51) AURKAPDGFRBKDRFGFR1RET
SCHEMBL5999815 0.85 AURKA (0.63) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6001664 0.84 AURKA (0.63) AURKAPDGFRBKDRFGFR1RET
SCHEMBL8474631 0.82 AURKA (0.66) AURKAPDGFRBKDRFGFR1RET
SCHEMBL7428873 0.73 PDGFRB (0.52) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6406125 0.73 PDGFRB (0.62) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6406128 0.73 PDGFRB (0.62) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6299845 0.71 KDR (0.55) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6389700 0.70 FGFR1 (0.67) AURKAPDGFRBKDRFGFR1RET
SCHEMBL6389704 0.70 FGFR1 (0.67) AURKAPDGFRBKDRFGFR1RET

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
EP-0769947-A4 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE SUGEN INC (US) 1998-09-30 EP disclosed
EP-0769947-A1 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE Sugen, Inc. (US) 1997-05-02 EP disclosed
WO-1996040116-A1 INDOLINONE COMPOUNDS FOR THE TREATMENT OF DISEASE SUGEN, INC. (US) 1996-12-19 WO disclosed