SCHEMBL4009946

SCHEMBL4009946

Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2cccc(CCN3CC[SH4]C(=O)C3=O)c2)n1

nearest known ligand 0.60

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.60

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
SCHEMBL1069705 0.86 BTK (0.62) BTK
SCHEMBL1068528 0.86 BTK (0.63) BTK
SCHEMBL1069840 0.85 BTK (0.72) BTK
SCHEMBL1069519 0.84 BTK (0.66) BTK
SCHEMBL1069618 0.84 BTK (0.65) BTK
SCHEMBL4008840 0.83 BTK (0.62) BTK
SCHEMBL12962461 0.83 BTK (0.69) BTK
SCHEMBL1069149 0.83 BTK (0.61) BTK
SCHEMBL14272226 0.83 BTK (0.61) BTK
SCHEMBL1070958 0.83 BTK (0.65) BTK

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
EP-2068849-A2 KINASE INHIBITORS, AND METHODS OF USING AND IDENTIFYING KINASE INHIBITORS CGI Pharmaceuticals, Inc. (US) 2009-06-17 EP disclosed
WO-2008033858-A2 KINASE INHIBITORS, AND METHODS OF USING AND IDENTIFYING KINASE INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2008-03-20 WO disclosed