SCHEMBL13837940

SCHEMBL13837940

Cc1ccc(NC(=O)c2cccc(C(C)(C)N)c2)cc1-n1c(=O)n(C)c2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHB4 P54760 3/20 0.51
▸ ABL1 P00519 5/20 0.46
▸ TEK Q02763 4/20 0.46
▸ LCK P06239 4/20 0.46
▸ KDR P35968 3/20 0.46
▸ KIT P10721 3/20 0.46
▸ SRC P12931 3/20 0.46
▸ TNK2 Q07912 2/20 0.46
▸ MAP4K2 Q12851 2/20 0.46
▸ FES P07332 1/20 0.46
▸ RET P07949 1/20 0.46
▸ PDGFRB P09619 1/20 0.46
▸ FGFR1 P11362 1/20 0.46
▸ PDGFRA P16234 1/20 0.46
▸ FLT1 P17948 1/20 0.46
▸ FGFR3 P22607 1/20 0.46
▸ EPHA3 P29320 1/20 0.46
▸ BMX P51813 1/20 0.46
▸ KARS1 Q15046 1/20 0.46
▸ NTRK3 Q16288 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
SCHEMBL16194905 0.88 BRAF (0.54) BRAF
SCHEMBL16195447 0.78 BRPF1 (0.56) BRD4BRPF1BRAF
SCHEMBL10092868 0.76 CSF1R (0.55) ABL1LCKKDRKITSRC
SCHEMBL13838142 0.74 RAB9A (0.53) ABL1LCKKDRKITSRC
SCHEMBL13837913 0.73 CSF1R (0.53) ABL1LCKKDRKITSRC
SCHEMBL3139779 0.72 TNK2 (0.62) EPHB4ABL1TEKLCKKDR
SCHEMBL13837919 0.72 NPC1 (0.32) EPHB4
SCHEMBL12065276 0.70 LCK (0.55) ABL1LCKKDRKITSRC
SCHEMBL30338817 0.70 SYK (0.57) EPHB4ABL1TEKLCKKDR
SCHEMBL3135923 0.70 SYK (0.57) EPHB4ABL1TEKLCKKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012148792-A1 HETEROCYCLIC COMPOUNDS AS B-RAF INHIBITORS FOR TREATMENT OF CANCER MERCK SHARP & DOHME CORP. (US) 2012-11-01 — — WO disclosed
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