SCHEMBL6505582

SCHEMBL6505582

CCC(C(=O)O)N(Cc1ccc(OCCn2c3ccccc3c3ccccc32)cc1)C(=O)Oc1ccc(OC)cc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.54
PPARA Q07869 6/20 0.54
PPARD Q03181 1/20 0.54
TSPO P30536 1/20 0.48
SMPD1 P17405 3/20 0.45
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 1/20 0.43
BACE1 P56817 2/20 0.42
TP53 P04637 1/20 0.40

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
SCHEMBL5431844 0.86 PPARG (0.44) PPARGPPARASMPD1LMNANPSR1
SCHEMBL5423631 0.84 SMN1; SMN2 (0.53) PPARGPPARALMNANPSR1
SCHEMBL5440280 0.82 PPARA (0.57) PPARGPPARAPPARDSMPD1
SCHEMBL5441860 0.82 PPARA (0.56) PPARGPPARAPPARDTSPOSMPD1
SCHEMBL5427770 0.81 SMPD1 (0.44) PPARGPPARASMPD1BACE1TP53
SCHEMBL5432386 0.80 POLB (0.51) POLB
SCHEMBL5441849 0.79 RAB9A (0.50) PPARGPOLBTP53
SCHEMBL5438445 0.79 MAPT (0.46) PPARGPOLB
SCHEMBL5431889 0.79 PGR (0.61) PPARGPPARAPPARDLMNANPSR1
SCHEMBL5430265 0.79 PPARA (0.35) PPARGPPARAPPARDPOLB

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
WO-2005049589-A2 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA, DIABETES, OBESITY AND SIMILAR DISEASES CADILA HEALTHCARE LIMITED (IN) 2005-06-02 WO claimed
WO-2005049589-A2 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA, DIABETES, OBESITY AND SIMILAR DISEASES CADILA HEALTHCARE LIMITED (IN) 2005-06-02 WO disclosed