SCHEMBL14265752

SCHEMBL14265752

CCOC(=O)[C@H](Cc1ccc(OCCN2CCOc3ccccc32)cc1)OCC

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.58
PPARA Q07869 16/20 0.58
PPARD Q03181 3/20 0.48
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45

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
SCHEMBL5107137 1.00 PPARG (0.58) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5100409 0.94 PPARG (0.54) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5107151 0.94 PPARG (0.57) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5101273 0.93 PPARG (0.53) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5107356 0.92 PPARG (0.69) PPARGPPARAPPARD
SCHEMBL14265753 0.92 PPARG (0.69) PPARGPPARAPPARD
SCHEMBL5107343 0.91 PPARG (0.51) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5107710 0.91 PPARG (0.58) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5101320 0.89 PPARG (0.56) PPARGPPARAPPARDLMNAMAPT
SCHEMBL5101224 0.89 PPARG (0.49) PPARGPPARALMNAMAPTRXFP1

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
US-7348426-B1 Substituted bicyclic heterocycles, process for their preparation and their use as antiobesity and hypocholesterolemic agents DR. REDDY'S LABORATIES LIMITED (IN) 2008-03-25 US disclosed