SCHEMBL25968469

SCHEMBL25968469

Cc1c(Cl)cc(C(F)(C(C)(F)F)C(C)(F)F)cc1OC(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.33
SLC1A5 Q15758 2/20 0.32
SLC22A12 Q96S37 1/20 0.31
CNR2 P34972 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
SCHEMBL25966607 0.91 PGK1 (0.31) PGK1
SCHEMBL21614495 0.90 PGK1 (0.35) PGK1SLC1A5
SCHEMBL23239915 0.77 PGK1 (0.41) PGK1SLC1A5CNR2
SCHEMBL10892087 0.77 PGK1 (0.37) PGK1SLC1A5CNR2
SCHEMBL29795913 0.74 CYP3A4 (0.37) PGK1SLC1A5
SCHEMBL23213536 0.74 CYP3A4 (0.37) PGK1SLC1A5
SCHEMBL4183063 0.71 CYP3A4 (0.33) PGK1SLC1A5
SCHEMBL16702806 0.71 SLC1A5 (0.34) PGK1SLC1A5
SCHEMBL24987805 0.68 RORC (0.39)
SCHEMBL18191163 0.68 SLC22A12 (0.33) SLC1A5SLC22A12

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-4003963-B1 PYRAZOLE DERIVATIVES FOR CONTROLLING ARTHROPODS ELANCO ANIMAL HEALTH GMBH (DE) 2023-08-16 EP disclosed