SCHEMBL2460140

SCHEMBL2460140

Cc1c(C2=CC(Nc3ccc(CN(C)C)nn3)C(=O)NN2C)ccc(F)c1NC(=O)c1cc2ccccc2s1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BTK Q06187 9/20 0.43
FGR P09769 1/20 0.43
SRC P12931 1/20 0.43
TEC P42680 1/20 0.43
BMX P51813 1/20 0.43
OPRM1 P35372 3/20 0.33
MCHR1 Q99705 1/20 0.33
DGAT1 O75907 1/20 0.32
F10 P00742 1/20 0.32
BCL6 P41182 1/20 0.32
CCR8 P51685 1/20 0.32
TMIGD3 P0DMS9 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
AKT1 P31749 1/20 0.31
IMPDH2 P12268 1/20 0.31

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
SCHEMBL9985033 0.78 BTK (0.52) BTKFGRSRCTECBMX
SCHEMBL2463009 0.78 BTK (0.49) BTKFGRSRCTECBMX
SCHEMBL2463010 0.76 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL19971530 0.72 BTK (0.40) BTKFGRSRCTECBMX
SCHEMBL2462645 0.68 BTK (0.38) BTKF10
SCHEMBL19981552 0.66 BTK (0.59) BTKFGRSRCTECBMX
SCHEMBL2491887 0.63 BTK (0.69) BTKFGRSRCTECBMX
SCHEMBL2493067 0.63 BTK (0.71) BTKFGRSRCTECBMX
SCHEMBL9984618 0.63 BTK (0.75) BTKFGRSRCTECBMX
SCHEMBL2495061 0.62 BTK (0.67) BTKFGRSRCTECBMX

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-2365970-A1 Pyridazinones and their use as btk inhibitors CGI Pharmaceuticals, Inc. (US) 2011-09-21 EP claimed
WO-2010056875-A1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS CGI PHARMACEUTICALS, INC. (US) 2010-05-20 WO claimed