SCHEMBL9660558

SCHEMBL9660558

CCCOc1c(OC)cc(C2CCC(=O)O2)cc1S(=O)(=O)CCO

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 19/20 0.74

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
SCHEMBL9401188 0.86 PTAFR (0.58) PTAFR
SCHEMBL9859555 0.85 PTAFR (1.00) PTAFR
SCHEMBL9859558 0.85 PTAFR (1.00) PTAFR
SCHEMBL8752379 0.85 PTAFR (1.00) PTAFR
SCHEMBL9401186 0.84 PTAFR (0.54) PTAFR
SCHEMBL9689913 0.83 PTAFR (0.96) PTAFR
SCHEMBL9689907 0.83 PTAFR (0.96) PTAFR
SCHEMBL9689918 0.83 PTAFR (0.96) PTAFR
SCHEMBL12374735 0.82 PTAFR (0.85) PTAFR
SCHEMBL9661992 0.81 PTAFR (0.48) PTAFR

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-0478063-A1 Method of making optically active alcohols MERCK & CO. INC. (US) 1992-04-01 EP disclosed