SCHEMBL22561987

SCHEMBL22561987

C=C(Nc1ccc(C)c(-c2cnc(-n3ccc(=O)cc3)c(C#N)c2)c1)c1ccnc(C(C)(C)C#N)c1

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 20/20 0.48
BRAF P15056 19/20 0.48

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
SCHEMBL19327983 0.93 RAF1 (0.57) RAF1BRAF
SCHEMBL19327933 0.84 RAF1 (0.54) RAF1BRAF
SCHEMBL22562030 0.83 RAF1 (0.50) RAF1BRAF
SCHEMBL22562051 0.79 RAF1 (0.56) RAF1BRAF
SCHEMBL17591668 0.78 RAF1 (0.67) RAF1BRAF
SCHEMBL19343153 0.78 RAF1 (0.62) RAF1BRAF
SCHEMBL17591638 0.77 RAF1 (0.75) RAF1BRAF
SCHEMBL19327946 0.77 RAF1 (0.68) RAF1BRAF
SCHEMBL19328035 0.77 RAF1 (0.61) RAF1BRAF
SCHEMBL19328127 0.76 RAF1 (0.60) 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-3191467-B1 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS NOVARTIS AG (CH) 2020-10-21 EP disclosed