SCHEMBL1404764

SCHEMBL1404764

Cc1ccc(C(=O)Nc2cc(C(C)(C)C)cc(C#N)c2[S+](C)[O-])cc1-n1cc(OC(=O)NCC(C)(C)C)nn1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRAF P15056 18/20 0.34
GPR142 Q7Z601 1/20 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
SCHEMBL1404597 0.89 BRAF (0.35) BRAFGPR142
SCHEMBL1404662 0.88 MAPK14 (0.38) BRAF
SCHEMBL1404560 0.86 BRAF (0.37) BRAFGPR142
SCHEMBL1404647 0.85 BRAF (0.36) BRAF
SCHEMBL4466858 0.83 BRAF (0.36) BRAFGPR142
SCHEMBL1404811 0.82 BRAF (0.38) BRAFGPR142
SCHEMBL1404734 0.81 BRAF (0.38) BRAFGPR142
SCHEMBL1404899 0.81 BRAF (0.40) BRAFGPR142
SCHEMBL1404833 0.81 BRAF (0.37) BRAFGPR142
SCHEMBL1404576 0.80 BRAF (0.39) BRAF

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-1692116-B1 1,2,3-TRIAZOLE AMIDE DERIVATIVES AS INHIBITORS OF CYTOKINE PRODUCTION BOEHRINGER INGELHEIM PHARMA (US) 2011-03-09 EP claimed