SCHEMBL7716821

SCHEMBL7716821

Cc1[nH]c(C=O)c(C)c1CCC(=O)OC(=O)CCc1c(C)[nH]c(C=C2C(=O)Nc3ccc(I)cc32)c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 15/20 0.60
▸ FGFR1 P11362 13/20 0.60
▸ PDGFRB P09619 12/20 0.60
▸ EGFR P00533 5/20 0.56
▸ AURKA O14965 3/20 0.56
▸ FLT3 P36888 3/20 0.56
▸ RET P07949 2/20 0.56
▸ FLT1 P17948 2/20 0.56
▸ MAP4K2 Q12851 2/20 0.56
▸ STK3 Q13188 2/20 0.56
▸ AURKB Q96GD4 2/20 0.56
▸ CHEK1 O14757 2/20 0.56
▸ ALK Q9UM73 2/20 0.56
▸ FLT4 P35916 2/20 0.56
▸ GAK O14976 1/20 0.56
▸ RPS6KA5 O75582 1/20 0.56
▸ RPS6KA4 O75676 1/20 0.56
▸ LATS1 O95835 1/20 0.56
▸ CSNK2A2 P19784 1/20 0.56
▸ MAP2K2 P36507 1/20 0.56

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
SCHEMBL7716817 0.91 KDR (0.73) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL7716818 0.91 KDR (0.73) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL4409722 0.87 KDR (0.78) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL4409721 0.87 KDR (0.78) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL5370172 0.80 KDR (0.59) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL31726830 0.77 ALK (0.76) KDRFGFR1PDGFRBAURKAFLT3
SCHEMBL31726848 0.77 PDGFRB (0.74) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL5376617 0.77 PDGFRB (0.74) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL4405035 0.77 KDR (0.81) KDRFGFR1PDGFRBEGFRAURKA
SCHEMBL4405036 0.77 KDR (0.81) KDRFGFR1PDGFRBEGFRAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1233943-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS Sugen, Inc. (US) 2002-08-28 — — EP disclosed
EP-1082305-A4 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS SUGEN INC (US) 2001-09-26 — — EP disclosed
WO-2001037820-A2 IONIZABLE INDOLINONE DERIVATIVES AND THEIR USE AS PTK LIGANDS SUGEN, INC. (US) 2001-05-31 — — WO disclosed
EP-1082305-A1 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS Sugen, Inc. (US) 2001-03-14 — — EP disclosed
WO-1999061422-A1 PYRROLE SUBSTITUTED 2-INDOLINONE PROTEIN KINASE INHIBITORS SUGEN, INC. (US) 1999-12-02 — — WO disclosed
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