SCHEMBL9693071

SCHEMBL9693071

C#CCOc1cc(N2C(=C)C(C)OC2=O)c(F)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PPOX P50336 11/20 0.38
PGK1 P00558 1/20 0.34

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
SCHEMBL9620031 0.80 PPOX (0.39) PPOXPGK1
SCHEMBL10448351 0.78 PPOX (0.43) PPOXPGK1
SCHEMBL10690143 0.77 PPOX (0.43) PPOXPGK1
SCHEMBL9577496 0.74 PPOX (0.38) PPOXPGK1
SCHEMBL8879696 0.73 PPOX (0.40) PPOXPGK1
SCHEMBL10581434 0.72 PPOX (0.47) PPOX
SCHEMBL10703380 0.72 PPOX (0.40) PPOX
SCHEMBL9577518 0.72 PPOX (0.38) PPOXPGK1
SCHEMBL8684442 0.72 PPOX (0.43) PPOX
SCHEMBL29448833 0.72 PPOX (0.51) PPOX

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-0484776-A1 Arylsubstituted alkyliden-nitrogenheterocycles BAYER AG (DE) 1992-05-13 EP disclosed