SCHEMBL5260753

SCHEMBL5260753

Cc1c(C(=O)NCc2ccc(S(N)(=O)=O)cc2)nc(-c2ccc(F)cc2)n1CCC(O)CC(O)CC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 5/20 0.68

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
SCHEMBL5227595 1.00 HMGCR (0.68) HMGCR
SCHEMBL5225119 0.92 HMGCR (0.81) HMGCR
SCHEMBL5224981 0.89 HMGCR (0.84) HMGCR
SCHEMBL6362548 0.85 HMGCR (0.82) HMGCR
SCHEMBL5222552 0.84 HMGCR (0.69) HMGCR
SCHEMBL5996701 0.84 HMGCR (0.93) HMGCR
SCHEMBL5991693 0.83 HMGCR (0.74) HMGCR
SCHEMBL6362203 0.81 HMGCR (1.00) HMGCR
SCHEMBL5224424 0.81 HMGCR (0.70) HMGCR
SCHEMBL4730997 0.81 HMGCR (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1740549-A2 NOVEL IMIDAZOLES Warner-Lambert Company LLC (US) 2007-01-10 EP disclosed
WO-2005105079-A2 NOVEL IMIDAZOLES WARNER-LAMBERT COMPANY LLC (US) 2005-11-10 WO disclosed