SCHEMBL19981552

SCHEMBL19981552

Cc1c(-c2ccc(=O)[nH]n2)ccc(F)c1NC(=O)c1cc2ccccc2s1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 11/20 0.59
FGR P09769 1/20 0.59
SRC P12931 1/20 0.59
TEC P42680 1/20 0.59
BMX P51813 1/20 0.59
TMIGD3 P0DMS9 4/20 0.44
ADORA1 P30542 4/20 0.44
STAT1 P42224 1/20 0.44
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
F10 P00742 1/20 0.43
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL9984618 0.78 BTK (0.75) BTKFGRSRCTECBMX
SCHEMBL2462218 0.78 BTK (0.64) BTKFGRSRCTECBMX
SCHEMBL2491887 0.77 BTK (0.69) BTKFGRSRCTECBMX
SCHEMBL9984587 0.77 BTK (0.71) BTKFGRSRCTECBMX
SCHEMBL2493067 0.77 BTK (0.71) BTKFGRSRCTECBMX
SCHEMBL12045262 0.76 BTK (0.66) BTKFGRSRCTECBMX
SCHEMBL2463010 0.75 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL2490032 0.75 BTK (0.81) BTKFGRSRCTECBMX
SCHEMBL9985377 0.75 BTK (0.57) BTKFGRSRCTECBMX
SCHEMBL2491369 0.75 BTK (1.00) 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