SCHEMBL10264685

SCHEMBL10264685

CC(C)(CCC(O)Cc1ccc(CC(O)CCC(C)(C)C(P)Oc2ccccc2)cc1)C(=O)Oc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.38
PPARA Q07869 16/20 0.38
ELANE P08246 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL6180739 0.89 ELANE (0.43) PPARGPPARAELANE
SCHEMBL2736910 0.79 ELANE (0.49) PPARAELANE
SCHEMBL6184013 0.76 ELANE (0.46) PPARAELANE
SCHEMBL13053746 0.73 ALDH1A1 (0.44) PPARGPPARA
SCHEMBL13053751 0.71 CTRB1 (0.38) PPARGPPARAELANE
SCHEMBL12094474 0.71 ACACB (0.53) PPARAELANE
SCHEMBL6183996 0.71 RIPK1 (0.53) PPARAELANE
SCHEMBL2737051 0.70 ELANE (0.40) PPARAELANE
SCHEMBL12092652 0.70 ACACB (0.55) PPARAELANE
SCHEMBL10257325 0.70 ACACB (0.49) PPARA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2404890-A1 Hydroxyl compounds and compositions for cholesterol management and related uses Esperion Therapeutics Inc. (US) 2012-01-11 EP disclosed