SCHEMBL8049826

SCHEMBL8049826

CCOCOc1c(C)c(C)c2c(c1C)CC[C@](C)(C=CCCOc1ccc(OCCCC(C)(C)C(=O)O)cc1)O2

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 8/20 0.41
PPARA Q07869 11/20 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
SCHEMBL8618675 0.88 PPARA (0.42) PPARA
SCHEMBL8923656 0.80 PSEN1 (0.38) PSEN1PPARA
SCHEMBL8923654 0.80 PSEN1 (0.38) PSEN1PPARA
SCHEMBL8923653 0.80 PSEN1 (0.38) PSEN1PPARA
SCHEMBL8050778 0.72 PSEN1 (0.43) PSEN1
SCHEMBL13084677 0.71 PSEN1 (0.48) PSEN1
SCHEMBL627714 0.71 PSEN1 (0.60) PSEN1PPARA
SCHEMBL627713 0.71 PSEN1 (0.60) PSEN1PPARA
SCHEMBL627712 0.71 PSEN1 (0.60) PSEN1PPARA
SCHEMBL8039151 0.71 PSEN1 (0.42) PSEN1PPARA

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
EP-0763527-B1 Substituted 2,2-dimethyl-omega-phenoxy alkanoic acids and esters, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-04-26 EP disclosed
EP-0763527-A1 Substituted 2,2-dimethyl-omega-phenoxy alkanoic acids and esters, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1997-03-19 EP disclosed