SCHEMBL19971531

SCHEMBL19971531

Cc1cc(NC(=O)c2cc3ccccc3s2)c(F)c(-c2cc(Nc3ccc(N4CCC(F)(F)C4)cn3)c(=O)n(C)n2)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BTK Q06187 13/20 0.40
FGR P09769 1/20 0.39
SRC P12931 1/20 0.39
TEC P42680 1/20 0.39
BMX P51813 1/20 0.39
TYK2 P29597 1/20 0.37
F10 P00742 1/20 0.35
EP300 Q09472 2/20 0.35
BCL6 P41182 1/20 0.34
HTR1A P08908 1/20 0.34
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33

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
SCHEMBL2495237 0.89 BTK (0.52) BTKFGRSRCTECBMX
SCHEMBL2462583 0.77 BTK (0.63) BTKFGRSRCTECBMX
SCHEMBL2495235 0.76 BTK (0.52) BTKFGRSRCTECBMX
SCHEMBL2462097 0.76 BTK (0.52) BTKFGRSRCTECBMX
SCHEMBL2493454 0.74 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL2491746 0.71 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL2491968 0.71 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL2490839 0.71 BTK (0.53) BTKFGRSRCTECBMX
SCHEMBL2461586 0.71 BTK (0.51) BTKFGRSRCTECBMX
SCHEMBL9985372 0.71 BTK (0.55) 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