SCHEMBL19981725

SCHEMBL19981725

Cc1c(C(=N)/C=C(/Nc2ccn(C)n2)C(N)=O)ccc(F)c1NC(=O)c1cc2ccccc2s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 8/20 0.45
FGR P09769 1/20 0.45
SRC P12931 1/20 0.45
TEC P42680 1/20 0.45
BMX P51813 1/20 0.45
F10 P00742 1/20 0.38
PTGDR2 Q9Y5Y4 1/20 0.35
TMIGD3 P0DMS9 2/20 0.35
ADORA1 P30542 2/20 0.35
STAT1 P42224 1/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
STIM1 Q13586 1/20 0.35
ORAI1 Q96D31 1/20 0.35
DGAT1 O75907 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
HDAC3 O15379 1/20 0.34

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
SCHEMBL19981932 0.81 CLK1 (0.38) BTKFGRSRCTECBMX
SCHEMBL19981750 0.81 BTK (0.37) BTKFGRSRCTECBMX
SCHEMBL19981969 0.81 HDAC3 (0.38) BTKFGRSRCTECBMX
SCHEMBL19981966 0.80 BTK (0.37) BTKFGRSRCTECBMX
SCHEMBL19981813 0.80 BTK (0.36) BTKFGRSRCTECBMX
SCHEMBL19981562 0.79 SLC9A1 (0.36) BTKFGRSRCTECBMX
SCHEMBL19981793 0.79 CLK1 (0.42) BTKFGRSRCTECBMX
SCHEMBL12025148 0.73 BTK (0.43) BTKFGRSRCTECBMX
SCHEMBL19981978 0.73 BTK (0.32) BTKFGRSRCTECBMX
SCHEMBL19981920 0.71 BTK (0.39) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2365970-B1 PYRIDAZINONES AND THEIR USE AS BTK INHIBITORS GILEAD CONNECTICUT INC (US) 2018-03-21 EP disclosed