SCHEMBL10263167

SCHEMBL10263167

O=C(Nc1cccc(CF)c1)C1CCc2ccc(Oc3ccnc(C4=NCCN4)c3)cc2C1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRAF P15056 15/20 0.53
RAF1 P04049 13/20 0.53
KDR P35968 2/20 0.40
FAAH O00519 4/20 0.39
ACHE P22303 1/20 0.38

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
SCHEMBL545697 0.88 BRAF (0.58) BRAFRAF1KDR
SCHEMBL10262926 0.87 BRAF (0.47) BRAFRAF1KDR
SCHEMBL545191 0.87 BRAF (0.52) BRAFRAF1KDR
SCHEMBL545270 0.87 BRAF (0.52) BRAFRAF1KDR
SCHEMBL545645 0.87 BRAF (0.48) BRAFRAF1KDRFAAH
SCHEMBL546193 0.87 BRAF (0.52) BRAFRAF1KDR
SCHEMBL14493297 0.83 BRAF (0.64) BRAFRAF1KDR
SCHEMBL545766 0.82 BRAF (0.58) BRAFRAF1KDR
SCHEMBL545179 0.82 BRAF (0.70) BRAFRAF1KDR
SCHEMBL547123 0.82 BRAF (0.70) BRAFRAF1KDR

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-8110687-B2 Bicyclic compounds with kinase inhibitory activity MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-02-07 US disclosed