Sugi Predict

Sugi Predict / Compounds / SCHEMBL4135526

SCHEMBL4135526

SCHEMBL4135526

Cc1c(NC(=O)c2ccc(C(C)(C)C)cc2)cccc1-c1cn(C)c(=O)c(Nc2ccccc2C(=O)O)n1.Cn1cc(-c2cccc(N(C(=O)c3ccccc3)C(C)(C)C)c2F)nc(Nc2ccc(-c3nnn[nH]3)cc2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 20/20 0.50

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
SCHEMBL4138491 0.90 BTK (0.40) BTK
SCHEMBL1069326 0.85 BTK (0.66) BTK
SCHEMBL1070784 0.83 BTK (0.56) BTK
SCHEMBL4002930 0.78 BTK (0.53) BTK
SCHEMBL1068492 0.76 BTK (0.76) BTK
SCHEMBL1067971 0.75 BTK (0.75) BTK
SCHEMBL12637670 0.75 BTK (0.75) BTK
SCHEMBL1067583 0.75 BTK (0.66) BTK
SCHEMBL1069275 0.74 BTK (0.68) BTK
SCHEMBL12637673 0.73 BTK (0.75) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863766-A2 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI Pharmaceuticals, Inc. (US) 2007-12-12 — — EP claimed
WO-2006099075-A2 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. (US) 2006-09-21 — — WO claimed
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
EP-1863766-A2 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI Pharmaceuticals, Inc. (US) 2007-12-12 — — EP disclosed
WO-2006099075-A2 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. (US) 2006-09-21 — — WO disclosed