SCHEMBL7096182

SCHEMBL7096182

CCCc1nn(C)c2c(=O)n(CCOc3ccc(CC(OCC)C(=O)OCC)cc3)c(Cc3ccccc3)nc12

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 17/20 0.46
PPARG P37231 17/20 0.46
PPARD Q03181 2/20 0.46
PGR P06401 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
CHRM1 P11229 1/20 0.39
TBXA2R P21731 1/20 0.39
PTGS1 P23219 1/20 0.39
SLC6A2 P23975 1/20 0.39
PDE4A P27815 1/20 0.39
ADRA1A P35348 1/20 0.39
DRD3 P35462 1/20 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
SCHEMBL7093575 0.94 PPARG (0.53) PPARAPPARGPPARDPGRADORA3
SCHEMBL7006668 0.93 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL7093366 0.92 PPARA (0.45) PPARAPPARGPPARDPGRADORA3
SCHEMBL7092810 0.92 PPARA (0.44) PPARAPPARGPPARDPGRADORA3
SCHEMBL7092535 0.88 PPARG (0.45) PPARAPPARGPPARDPGRADORA3
SCHEMBL7095559 0.88 PPARG (0.46) PPARAPPARGPPARD
SCHEMBL7096427 0.88 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL7098374 0.87 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL7092188 0.87 PPARG (0.52) PPARAPPARGPPARDPGRADORA3
SCHEMBL7091645 0.86 PPARG (0.51) PPARAPPARGPPARDPGRADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6444816-B1 DIETETICS, ANTICHOLESTEROL AGENTS, ANTIDIABETIC AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2002-09-03 US claimed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP claimed
EP-1363914-A1 ARYL SUBSTITUTED ALKYLCARBOXYLIC ACIDS AS HYPOCHOLESTEROLEMIC AGENTS Dr. Reddy's Laboratories Ltd. (IN) 2003-11-26 EP disclosed
US-6444816-B1 DIETETICS, ANTICHOLESTEROL AGENTS, ANTIDIABETIC AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2002-09-03 US disclosed
WO-2002062799-A1 ARYL SUBSTITUTED ALKYLCARBOXYLIC ACIDS AS HYPOCHOLESTEROLEMIC AGENTS DR. REDDY'S LABORATORIES LTD. (IN) 2002-08-15 WO disclosed
US-6376484-B1 FOR PREVENTION AND/OR TREATMENT OF VARIOUS KINDS OF INFLAMMATORY DISEASE ONO PHARMACEUTICAL CO., LTD. (JP) 2002-04-23 US disclosed
EP-0900791-A1 TETRAZOLE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 1999-03-10 EP disclosed