SCHEMBL3963771

SCHEMBL3963771

Cc1c(NC(=O)c2cc3c(s2)CCCC3)cccc1-c1c[nH]c(=O)c(CNc2ccc(N3CCN(C(C)C)CC3)cn2)c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.45
EGFR P00533 1/20 0.37
BMX P51813 1/20 0.37
JAK3 P52333 1/20 0.37

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
SCHEMBL3960170 0.85 BTK (0.56) BTKBMX
SCHEMBL3965260 0.83 BTK (0.46) BTKEGFRBMXJAK3
SCHEMBL1321976 0.83 BTK (0.57) BTKEGFRBMXJAK3
SCHEMBL3960660 0.83 BTK (0.39) BTK
SCHEMBL3964069 0.81 BTK (0.44) BTKEGFRBMXJAK3
SCHEMBL1323095 0.81 BTK (0.69) BTKEGFRBMXJAK3
SCHEMBL9984224 0.81 BTK (0.49) BTK
SCHEMBL1323121 0.81 BTK (0.69) BTKEGFRBMXJAK3
SCHEMBL1323037 0.75 BTK (0.74) BTKEGFRBMXJAK3
SCHEMBL1323329 0.74 BTK (0.73) BTKEGFRBMXJAK3

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-2081923-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI Pharmaceuticals, Inc. (US) 2009-07-29 EP disclosed
WO-2008033854-A1 CERTAIN SUBSTITUTED AMIDES, METHOD OF MAKING, AND METHOD OF USE THEREOF CGI PHARMACEUTICALS, INC. (US) 2008-03-20 WO disclosed