SCHEMBL4758295

SCHEMBL4758295

Cc1cc(C(=O)Nc2cccc(C(=O)c3ccc4c(c3)NC(=O)C4=CNc3ccc(NCCCN4CCN(C)CC4)cc3)c2)n(C)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 7/20 0.43
FGFR1 P11362 3/20 0.43
NTRK1 P04629 7/20 0.39
NTRK3 Q16288 1/20 0.39
RET P07949 1/20 0.38
INSR P06213 3/20 0.38
LCK P06239 3/20 0.38
LYN P07948 3/20 0.38
HCK P08631 3/20 0.38
SRC P12931 3/20 0.38
NTRK2 Q16620 6/20 0.37
CSF1R P07333 1/20 0.37

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
SCHEMBL3571787 0.85 KDR (0.48) KDRFGFR1NTRK1NTRK3SRC
SCHEMBL3571783 0.85 KDR (0.48) KDRFGFR1NTRK1NTRK3SRC
SCHEMBL13255716 0.85 KDR (0.44) KDRFGFR1NTRK1NTRK3RET
SCHEMBL3579266 0.84 HTR7 (0.45) KDRFGFR1NTRK1NTRK3RET
SCHEMBL3577933 0.83 KDR (0.46) KDRFGFR1NTRK1SRCNTRK2
SCHEMBL3577932 0.83 KDR (0.46) KDRFGFR1NTRK1SRCNTRK2
SCHEMBL3579269 0.83 HTR7 (0.39) KDRFGFR1NTRK1NTRK3RET
SCHEMBL3575229 0.82 KDR (0.44) KDRFGFR1NTRK1SRCNTRK2
SCHEMBL3575231 0.82 KDR (0.44) KDRFGFR1NTRK1SRCNTRK2
SCHEMBL3572738 0.82 KDR (0.45) KDRFGFR1NTRK1SRCNTRK2

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-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP claimed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 WO claimed