SCHEMBL5620172

SCHEMBL5620172

COC(=O)c1cccc(C(=O)c2cn(-c3cc(C(=O)Nc4cc(C(C)(C)C)cc(NSC)c4OC)ccc3C)nn2)c1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR142 Q7Z601 3/20 0.39
ESRRA P11474 1/20 0.38
BRAF P15056 14/20 0.38
WDR5 P61964 1/20 0.34

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
SCHEMBL4482948 0.90 BRAF (0.47) BRAF
SCHEMBL5776694 0.84 BRAF (0.47) BRAF
SCHEMBL4483034 0.82 BRAF (0.49) BRAF
SCHEMBL4478013 0.80 BRAF (0.40) GPR142BRAF
SCHEMBL4490549 0.80 BRAF (0.52) BRAF
SCHEMBL4495840 0.80 BRAF (0.49) BRAF
SCHEMBL4487287 0.79 BRAF (0.48) BRAF
SCHEMBL4465326 0.78 P4HTM (0.41) BRAF
SCHEMBL4499185 0.78 BRAF (0.48) BRAF
SCHEMBL6194179 0.77 BRAF (0.49) 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
US-7166628-B2 Cytokine inhibitors BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-01-23 US claimed