SCHEMBL7096427

SCHEMBL7096427

CCCc1nn(C)c2c(=O)n(CCOc3ccc(CC(Oc4ccccc4)C(=O)OCC)cc3)c(CCC)nc12

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 7/20 0.48
PPARG P37231 6/20 0.42
PPARD Q03181 3/20 0.42
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
AGTR2 P50052 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
SCHEMBL7098374 0.96 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL7006668 0.95 PPARA (0.43) PPARAPPARGPPARD
SCHEMBL7096057 0.93 PPARA (0.42) PPARAPPARGPPARDHPGD
SCHEMBL7092279 0.93 PPARA (0.47) PPARAPPARGPPARDHPGDSMN1; SMN2
SCHEMBL7093366 0.91 PPARA (0.45) PPARAPPARGPPARD
SCHEMBL7092433 0.89 PPARG (0.47) PPARAPPARGPPARD
SCHEMBL7096182 0.88 PPARA (0.46) PPARAPPARGPPARD
SCHEMBL7095559 0.88 PPARG (0.46) PPARAPPARGPPARD
SCHEMBL7092810 0.87 PPARA (0.44) PPARAPPARGPPARD
SCHEMBL7093145 0.87 PPARG (0.49) PPARAPPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363914-A1 ARYL SUBSTITUTED ALKYLCARBOXYLIC ACIDS AS HYPOCHOLESTEROLEMIC AGENTS Dr. Reddy's Laboratories Ltd. (IN) 2003-11-26 EP claimed
US-6444816-B1 DIETETICS, ANTICHOLESTEROL AGENTS, ANTIDIABETIC AGENTS DR. REDDY'S RESEARCH FOUNDATION (IN) 2002-09-03 US claimed
WO-2002062799-A1 ARYL SUBSTITUTED ALKYLCARBOXYLIC ACIDS AS HYPOCHOLESTEROLEMIC AGENTS DR. REDDY'S LABORATORIES LTD. (IN) 2002-08-15 WO 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