SCHEMBL3965301

SCHEMBL3965301

Cc1[nH]c(=O)c(Nc2ccc(C(=O)N3CCOCC3)cn2)cc1-c1cc(F)cc(NC(=O)c2ccc(C(C)(C)C)cc2)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.55
CLK2 P49760 1/20 0.52
TYK2 P29597 1/20 0.43
KDM4E B2RXH2 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL3963446 0.93 BTK (0.60) BTKCLK2TYK2
SCHEMBL3961624 0.84 BTK (0.61) BTKCLK2KDM4ERAB9A
SCHEMBL1321952 0.83 BTK (0.74) BTKCLK2
SCHEMBL1322006 0.78 BTK (0.82) BTKCLK2
SCHEMBL3964890 0.76 BTK (0.61) BTKCLK2
SCHEMBL1322606 0.75 BTK (0.77) BTKCLK2
SCHEMBL4391307 0.73 BTK (0.50) BTKCLK2TYK2KDM4ERAB9A
SCHEMBL3655714 0.72 BTK (0.66) BTKCLK2
SCHEMBL13894012 0.72 BTK (0.78) BTKCLK2
SCHEMBL1725887 0.72 BTK (0.77) BTKCLK2

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