SCHEMBL9873152

SCHEMBL9873152

C#CCOc1cc(N2CC(C)=C(C)C[S+]2[O-])c(F)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.35
PPOX P50336 5/20 0.35
LMNA P02545 1/20 0.32

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
SCHEMBL9872162 0.73 PGK1 (0.40) PGK1PPOXLMNA
SCHEMBL10690143 0.72 PPOX (0.43) PGK1PPOXLMNA
SCHEMBL9661744 0.69 PGK1 (0.39) PGK1PPOXLMNA
SCHEMBL9663274 0.69 PGK1 (0.39) PGK1PPOXLMNA
SCHEMBL4077918 0.68 PPOX (0.40) PGK1PPOXLMNA
SCHEMBL10448351 0.68 PPOX (0.43) PGK1PPOX
SCHEMBL19038330 0.68 PGK1 (0.37) PGK1PPOX
SCHEMBL9662543 0.67 PGK1 (0.38) PGK1PPOXLMNA
SCHEMBL8684442 0.67 PPOX (0.43) PPOX
SCHEMBL314005 0.67 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
US-5017213-A Herbicides NIHON TOKUSHU NOYAKU SEIZO K. K. (JP) 1991-05-21 US disclosed