SCHEMBL31464892

SCHEMBL31464892

O=C(O)c1cc(C(F)(F)F)c(=O)[nH]n1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 15/20 0.47
DAO P14920 1/20 0.47
ASPH Q12797 1/20 0.45
HCAR3 P49019 3/20 0.43
CYTH3 O43739 1/20 0.43
BTK Q06187 1/20 0.43
EPN1 Q9Y6I3 1/20 0.43
KMO O15229 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL31465029 0.84 KMT2A (0.38) ASPHKMT2A
SCHEMBL2360520 0.76 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK
SCHEMBL24968908 0.75 TIPARP (0.43)
SCHEMBL31464989 0.72 NOTUM (0.40)
SCHEMBL24739443 0.72 BACE1 (0.37)
SCHEMBL24739044 0.72 NOTUM (0.40) MEN1KMT2A
SCHEMBL15633366 0.72 NOTUM (0.43)
SCHEMBL30991131 0.72 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK
SCHEMBL4240356 0.72 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK
SCHEMBL27087481 0.72 HCAR2 (0.52) HCAR2DAOHCAR3CYTH3BTK

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
CN-119968364-A Pyridazin-3 (2H) -one and pyridin-2 (1H) -one PARP inhibitor compounds 阿兹卡拉疗法公司 2025-05-09 CN disclosed