SCHEMBL9518306

SCHEMBL9518306

COC(=O)CC(O)CC(O)CCc1c(-c2ccc(F)cc2)cn(C2CCCCC2)c1C(C)C

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 5/20 0.81

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
SCHEMBL9750923 0.89 HMGCR (1.00) HMGCR
SCHEMBL9518621 0.83 HMGCR (0.62) HMGCR
SCHEMBL9518620 0.81 HMGCR (0.80) HMGCR
SCHEMBL9750901 0.80 HMGCR (0.53) HMGCR
SCHEMBL9750906 0.77 HMGCR (0.78) HMGCR
SCHEMBL9521499 0.76 HMGCR (0.62) HMGCR
SCHEMBL9521396 0.73 HMGCR (0.68) HMGCR
SCHEMBL9750867 0.73 HMGCR (0.66) HMGCR
SCHEMBL9756768 0.71 HMGCR (0.53) HMGCR
SCHEMBL9750729 0.71 HMGCR (0.58) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0300249-B1 7-[1H-pyrrol-3-yl]-substituted 3,5-dihydroxy-heptane acids, their corresponding delta-lactones and salts, processes for their manufacture, their use as medicines, pharmaceutical preparations and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1993-02-03 EP disclosed
US-5055484-A Anticholesterol and antilipemic agent HOECHST AKTIENGESELLSCHAFT (DE) 1991-10-08 US disclosed
EP-0300249-A1 7-[1H-pyrrol-3-yl]-substituted 3,5-dihydroxy-heptane acids, their corresponding delta-lactones and salts, processes for their manufacture, their use as medicines, pharmaceutical preparations and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-25 EP disclosed