SCHEMBL20009380

SCHEMBL20009380

C=C=C(Nc1ccc(C)c(C(=N)/C=C(\CN/C=C\N=C)N2CCCC2)c1)c1cccc(C(F)F)c1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 12/20 0.32
BRAF P15056 12/20 0.32

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
SCHEMBL20008286 0.66
SCHEMBL20009832 0.65
SCHEMBL19068913 0.61 RAF1 (0.53) RAF1BRAF
SCHEMBL20009394 0.55 BRAF (0.70) RAF1BRAF
SCHEMBL20009452 0.55 RAF1 (0.44) RAF1BRAF
SCHEMBL20009609 0.53 BTK (0.32) BRAF
SCHEMBL20008272 0.52 TP53 (0.40)
SCHEMBL20008223 0.50 TP53 (0.39)
SCHEMBL23197862 0.49 KDM4E (0.34)
SCHEMBL20008308 0.49 NPC1 (0.36)

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
EP-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed