SCHEMBL9799123

SCHEMBL9799123

Cn1nnnc1C(/C=C/C(O)CC(=O)CC(=O)OC(C)(C)C)=C(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.62

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
SCHEMBL10608540 1.00 HMGCR (0.62) HMGCR
SCHEMBL9799128 1.00 HMGCR (0.62) HMGCR
SCHEMBL9726639 0.89 HMGCR (0.64) HMGCR
SCHEMBL9726642 0.89 HMGCR (0.64) HMGCR
SCHEMBL9726525 0.89 HMGCR (0.49) HMGCR
SCHEMBL9726522 0.89 HMGCR (0.49) HMGCR
SCHEMBL9726530 0.89 HMGCR (0.49) HMGCR
SCHEMBL9726842 0.87 HMGCR (0.68) HMGCR
SCHEMBL9726845 0.87 HMGCR (0.68) HMGCR
SCHEMBL9726760 0.87 HMGCR (0.68) 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-5068346-A Anticholesterol agents BRISTOL-MYERS COMPANY (US) 1991-11-26 US claimed