SCHEMBL3434900

SCHEMBL3434900

COc1cc2ncnc(Nc3ccc(F)c(Cl)c3F)c2cc1O[C@H]1CCN(C(CC#CC=O)N2CCN(C)CC2)C1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.62
FLT1 P17948 2/20 0.59
KDR P35968 2/20 0.59
FGFR1 P11362 1/20 0.59
ERBB2 P04626 3/20 0.59
EPHA2 P29317 1/20 0.54
EPHB4 P54760 1/20 0.54

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
SCHEMBL3389179 0.85 EGFR (0.68) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL3395009 0.84 EGFR (0.65) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL3392073 0.84 ERBB2 (0.72) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL3434895 0.79 EGFR (0.70) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL9883236 0.79 EGFR (0.74) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL22962596 0.78 EGFR (0.81) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL4887224 0.77 ERBB2 (0.79) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL9883167 0.77 EGFR (0.84) EGFRFLT1KDRFGFR1ERBB2
SCHEMBL3424083 0.77 EGFR (1.00) EGFRERBB2EPHB4
SCHEMBL3695941 0.77 EGFR (1.00) EGFRERBB2EPHB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2167492-A2 NOVEL AMIDE DERIVATIVE FOR INHIBITING THE GROWTH OF CANCER CELLS Hanmi Pharm. Co., Ltd. (KR) 2010-03-31 EP disclosed
WO-2008150118-A2 NOVEL AMIDE DERIVATIVE FOR INHIBITING THE GROWTH OF CANCER CELLS HANMI PHARM. CO., LTD. (KR) 2008-12-11 WO disclosed