SCHEMBL9512781

SCHEMBL9512781

CC(C)c1cc(C(C)(C)C)cc(-c2ccc(F)cc2)c1OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GLRA1 P23415 2/20 0.44
HMGCR P04035 2/20 0.39

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
SCHEMBL9512819 0.84 HMGCR (0.51) GLRA1HMGCR
SCHEMBL8780169 0.84 HMGCR (0.53) GLRA1HMGCR
SCHEMBL9516080 0.78 GLRA1 (0.50) GLRA1
SCHEMBL8855126 0.75 MGAM (0.44) GLRA1HMGCR
SCHEMBL13508914 0.74 THRB (0.44)
SCHEMBL9857596 0.72 GCGR (0.41)
SCHEMBL9516053 0.72 CA1 (0.39)
SCHEMBL13508907 0.71 MAPT (0.40)
SCHEMBL8854960 0.71 GLRA1 (0.44) GLRA1
SCHEMBL8854947 0.71 MAOB (0.39) GLRA1HMGCR

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-0341681-B1 6-Phenoxymethyl-4-hydroxytetrahydropyran-2-ones and 6-thiophenoxymethyl-4-hydroxytetrahydropyran-2-ones, the corresponding dihydrocarboxylic-acid derivatives, salts and esters, process for preparing these compounds, their use as medicines, pharmaceutical compositions and phenols and thiophenols HOECHST AG (DE) 1993-12-29 EP disclosed
US-5166171-A Compounds for treatment of artheriosclerosis and hypercholesterolemia HOECHST AKTIENGESELLSCHAFT (DE) 1992-11-24 US disclosed
EP-0341681-A2 6-Phenoxymethyl-4-hydroxytetrahydropyran-2-ones and 6-thiophenoxymethyl-4-hydroxytetrahydropyran-2-ones, the corresponding dihydrocarboxylic-acid derivatives, salts and esters, process for preparing these compounds, their use as medicines, pharmaceutical compositions and phenols and thiophenols HOECHST AKTIENGESELLSCHAFT (DE) 1989-11-15 EP disclosed