SCHEMBL5779460

SCHEMBL5779460

CCN1CCC[C@@H]1CNC(=O)Oc1cn(-c2cc(C(=O)Nc3cc(C(C)(C)C)cc(NS(C)(=O)=O)c3OC)ccc2C)nn1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.47

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
SCHEMBL5809533 1.00 BRAF (0.47) BRAF
SCHEMBL5809161 0.89 BRAF (0.46) BRAF
SCHEMBL5813134 0.89 BRAF (0.46) BRAF
SCHEMBL5808598 0.88 BRAF (0.48) BRAF
SCHEMBL5779128 0.88 BRAF (0.53) BRAF
SCHEMBL5813856 0.86 BRAF (0.52) BRAF
SCHEMBL5780116 0.85 BRAF (0.48) BRAF
SCHEMBL5777976 0.85 BRAF (0.46) BRAF
SCHEMBL5779482 0.84 BRAF (0.47) BRAF
SCHEMBL5778311 0.84 BRAF (0.47) 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-1567507-B1 1,2,3- TRIAZOLE AMIDE DERIVATIVES AS CYTOKINE INHIBITORS BOEHRINGER INGELHEIM PHARMA (US) 2006-06-14 EP claimed