SCHEMBL19981579

SCHEMBL19981579

Cc1c(-c2cc(NC3C=CC(C(O)C(=O)N(C)C)=CP3)c(=O)[nH]n2)ccc(F)c1NC(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BTK Q06187 10/20 0.49
FGR P09769 1/20 0.35
SRC P12931 1/20 0.35
TEC P42680 1/20 0.35
BMX P51813 1/20 0.35
MAPK14 Q16539 1/20 0.30
PPARG P37231 1/20 0.30
NR1H4 Q96RI1 1/20 0.30

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
SCHEMBL2464078 0.79 BTK (0.59) BTKFGRSRCTECBMX
SCHEMBL2466168 0.79 BTK (0.59) BTKFGRSRCTECBMX
SCHEMBL2464076 0.79 BTK (0.59) BTKFGRSRCTECBMX
SCHEMBL2467939 0.71 BTK (0.66) BTKFGRSRCTECBMX
SCHEMBL9985729 0.67 BTK (0.48) BTKFGRSRCTECBMX
SCHEMBL2491394 0.67 BTK (0.48) BTKFGRSRCTECBMX
SCHEMBL9985142 0.67 BTK (0.48) BTKFGRSRCTECBMX
SCHEMBL9984772 0.66 BTK (1.00) BTKFGRSRCTECBMX
SCHEMBL2464013 0.64 BTK (0.38) BTK
SCHEMBL2462645 0.64 BTK (0.38) BTK

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