SCHEMBL14265754

SCHEMBL14265754

CCO[C@@H](Cc1ccc(OCCN2CCOc3ccccc32)cc1)C(O)O

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.49
PPARA Q07869 12/20 0.49
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
PPARD Q03181 1/20 0.39
TSHR P16473 1/20 0.39
HTR1A P08908 1/20 0.38
SLC6A4 P31645 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL14265718 0.85 PPARG (0.48) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5107356 0.85 PPARG (0.69) PPARGPPARAPPARD
SCHEMBL14265753 0.85 PPARG (0.69) PPARGPPARAPPARD
SCHEMBL4031998 0.84 PPARG (0.45) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5107710 0.84 PPARG (0.58) PPARGPPARALMNAMAPTRXFP1
SCHEMBL14265752 0.84 PPARG (0.58) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5107137 0.84 PPARG (0.58) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5101224 0.83 PPARG (0.49) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5107151 0.83 PPARG (0.57) PPARGPPARALMNAMAPTRXFP1
SCHEMBL5101320 0.82 PPARG (0.56) 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