SCHEMBL9872037

SCHEMBL9872037

CCc1cc(-c2ccc(F)cc2)c(/C=C/C2CC(O)CC(=O)O2)c(CC)n1

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 10/20 0.70

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
SCHEMBL9872024 1.00 HMGCR (0.70) HMGCR
SCHEMBL9872785 0.82 HMGCR (1.00) HMGCR
SCHEMBL9871127 0.80 HMGCR (0.58) HMGCR
SCHEMBL9527887 0.80 HMGCR (1.00) HMGCR
SCHEMBL9872047 0.79 HMGCR (1.00) HMGCR
SCHEMBL9023254 0.79 HMGCR (0.84) HMGCR
SCHEMBL9870944 0.79 HMGCR (0.84) HMGCR
SCHEMBL9872045 0.79 HMGCR (1.00) HMGCR
SCHEMBL9871336 0.79 HMGCR (0.81) HMGCR
SCHEMBL10425145 0.79 HMGCR (0.80) HMGCR

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-4997837-A Enzyme inhibitors WARNER-LAMBERT COMPANY (US) 1991-03-05 US disclosed