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SCHEMBL5778315

SCHEMBL5778315

COc1c(NC(=O)c2ccc(C)c(-n3cc(OC(=O)N[C@H](C)C(C)(C)C)nn3)c2)cc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BRAF P15056 19/20 0.47
▸ MAPK14 Q16539 1/20 0.42

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
SCHEMBL5778570 1.00 BRAF (0.47) BRAFMAPK14
SCHEMBL5777788 0.90 BRAF (0.45) BRAFMAPK14
SCHEMBL13757134 0.89 BRAF (0.48) BRAFMAPK14
SCHEMBL13757129 0.89 BRAF (0.48) BRAFMAPK14
SCHEMBL5777098 0.89 BRAF (0.51) BRAFMAPK14
SCHEMBL5780554 0.89 BRAF (0.45) BRAF
SCHEMBL5778395 0.89 BRAF (0.45) BRAF
SCHEMBL5775111 0.88 BRAF (0.50) BRAFMAPK14
SCHEMBL5779497 0.88 BRAF (0.43) BRAFMAPK14
SCHEMBL5778021 0.88 BRAF (0.49) 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 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