SCHEMBL5620583

SCHEMBL5620583

COc1c(NC(=O)c2ccc(C)c(-n3cc(C(=O)NCCc4ccccc4)nn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRAF P15056 17/20 0.46
MAPK14 Q16539 3/20 0.46

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
SCHEMBL4496075 0.94 MIF (0.47) BRAFMAPK14
SCHEMBL13757162 0.90 BRAF (0.49) BRAFMAPK14
SCHEMBL4483178 0.89 BRAF (0.49) BRAFMAPK14
SCHEMBL6807093 0.89 BRAF (0.49) BRAFMAPK14
SCHEMBL13757143 0.89 BRAF (0.49) BRAFMAPK14
SCHEMBL4507183 0.89 DDT (0.50) BRAFMAPK14
SCHEMBL5635761 0.89 BRAF (0.51) BRAFMAPK14
SCHEMBL4490020 0.88 BRAF (0.51) BRAFMAPK14
SCHEMBL4483034 0.88 BRAF (0.49) BRAFMAPK14
SCHEMBL6808232 0.88 BRAF (0.45) BRAFMAPK14

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166628-B2 Cytokine inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-01-23 US disclosed
EP-1567507-B1 1,2,3- TRIAZOLE AMIDE DERIVATIVES AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMA (US) 2006-06-14 EP disclosed