SCHEMBL20008551

SCHEMBL20008551

C=C(Nc1ccc(C)c(-c2ccc(CC3CCOCC3)nn2)c1)c1ccnc(C(C)(C)C#N)c1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 20/20 0.55
BRAF P15056 17/20 0.55

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
SCHEMBL20008347 0.84 RAF1 (0.47) RAF1BRAF
SCHEMBL20008539 0.76 RAF1 (0.49) RAF1BRAF
SCHEMBL20009189 0.75 RAF1 (0.36) RAF1BRAF
SCHEMBL16121459 0.71 RAF1 (1.00) RAF1BRAF
SCHEMBL16102241 0.70 RAF1 (1.00) RAF1BRAF
SCHEMBL16121463 0.69 RAF1 (1.00) RAF1BRAF
SCHEMBL19327960 0.69 RAF1 (0.68) RAF1BRAF
SCHEMBL16034675 0.69 RAF1 (1.00) RAF1BRAF
SCHEMBL16103052 0.69 RAF1 (1.00) RAF1BRAF
SCHEMBL16035718 0.68 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