SCHEMBL20008545

SCHEMBL20008545

C=C(Nc1cnc(C)c(-c2cc(CCC)nc(N3CCCCC3)c2)c1)c1ccnc(C(C)(C)C#N)c1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 20/20 0.61
BRAF P15056 20/20 0.61

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
SCHEMBL20008357 0.92 RAF1 (0.55) RAF1BRAF
SCHEMBL20009081 0.85 RAF1 (0.56) RAF1BRAF
SCHEMBL20009098 0.77 RAF1 (0.76) RAF1BRAF
SCHEMBL20008245 0.76 BRAF (0.71) RAF1BRAF
SCHEMBL16121356 0.76 RAF1 (1.00) RAF1BRAF
SCHEMBL16121731 0.74 BRAF (1.00) RAF1BRAF
SCHEMBL16121465 0.73 RAF1 (1.00) RAF1BRAF
SCHEMBL20010379 0.73 RAF1 (0.72) RAF1BRAF
SCHEMBL20008273 0.73 BRAF (0.51) RAF1BRAF
SCHEMBL16121708 0.72 RAF1 (1.00) RAF1BRAF

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