SCHEMBL9518620

SCHEMBL9518620

COC(=O)CC(O)CC(O)/C=C/c1c(-c2ccc(F)cc2)cn(C2CCCCC2)c1C(C)C

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 8/20 0.80

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
SCHEMBL9750985 0.89 HMGCR (1.00) HMGCR
SCHEMBL9521396 0.89 HMGCR (0.68) HMGCR
SCHEMBL9521423 0.84 HMGCR (0.79) HMGCR
SCHEMBL9773714 0.83 HMGCR (0.57) HMGCR
SCHEMBL9750835 0.82 HMGCR (0.79) HMGCR
SCHEMBL9518306 0.81 HMGCR (0.81) HMGCR
SCHEMBL9750860 0.78 HMGCR (0.78) HMGCR
SCHEMBL9518298 0.75 HMGCR (0.59) HMGCR
SCHEMBL9518290 0.75 HMGCR (0.59) HMGCR
SCHEMBL9750857 0.74 HMGCR (0.78) 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