SCHEMBL10425482

SCHEMBL10425482

COc1ccc(-c2nc(C)cc(C)c2/C=C/[C@@H]2C[C@@H](O)CC(=O)O2)cc1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 6/20 0.59

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
SCHEMBL10424679 0.89 HMGCR (0.63) HMGCR
SCHEMBL9871063 0.88 HMGCR (0.74) HMGCR
SCHEMBL10424692 0.88 HMGCR (0.74) HMGCR
SCHEMBL10424680 0.85 HMGCR (0.79) HMGCR
SCHEMBL10424089 0.82 HMGCR (0.82) HMGCR
SCHEMBL9022876 0.79 HMGCR (0.81) HMGCR
SCHEMBL10424071 0.77 HMGCR (0.78) HMGCR
SCHEMBL10425481 0.77 HMGCR (0.79) HMGCR
SCHEMBL10425480 0.74 HMGCR (0.88) HMGCR
SCHEMBL9872785 0.73 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
US-4925852-A TREATMENT OR PROPHYLAXIS OF ARTERIOSCLEROSIS OR HYPERCHOLESTEROLEMIA HOECHST AKTIENGESELLSCHAFT (DE) 1990-05-15 US disclosed
EP-0307342-A2 3-Demethyl-4-fluoro-mevalonic-acid derivatives, process for their preparation, pharmaceutical preparations based on those compounds, their use and intermediates HOECHST AKTIENGESELLSCHAFT (DE) 1989-03-15 EP disclosed