SCHEMBL4841446

SCHEMBL4841446

Cc1cccc(COCCCOCc2ccc3ccccc3n2)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 12/20 0.47
GPBAR1 Q8TDU6 5/20 0.47
CYSLTR2 Q9NS75 8/20 0.47
CYP1A2 P05177 1/20 0.42

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
SCHEMBL4848359 0.98 CYSLTR1 (0.50) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4850064 0.97 CYSLTR1 (0.49) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27557740 0.94 CYSLTR1 (0.44) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27558202 0.91 CYSLTR1 (0.47) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27578321 0.91 CYSLTR1 (0.46) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4844970 0.89 CYSLTR1 (0.50) CYSLTR1GPBAR1CYSLTR2CYP1A2
SCHEMBL14045446 0.88 CYSLTR1 (0.43) CYSLTR1GPBAR1CYSLTR2CYP1A2
SCHEMBL14021730 0.87 MAPT (0.42) CYSLTR1GPBAR1CYSLTR2CYP1A2
SCHEMBL4848684 0.87 CYSLTR1 (0.46) CYSLTR1GPBAR1CYSLTR2CYP1A2
SCHEMBL4848377 0.87 CYSLTR1 (0.53) CYSLTR1GPBAR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US claimed
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
US-RE40558-E1 Therapeutic uses of di-aryl acid derivatives SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-10-28 US disclosed
CN-101070316-A Diaryl acid derivatives as PPAR receptor ligands AVENTIS PHARMA GMBH (DE) 2007-11-14 CN disclosed
CN-1331862-C Diaryl acid derivatives as PPAR receptor ligands AVENTIS PHARAMCEUTICALS PRODUC (DE) 2007-08-15 CN disclosed
EP-1177187-B1 DI-ARYL ACID DERIVATIVES AS PPAR RECEPTOR LIGANDS SANOFI AVENTIS DEUTSCHLAND (DE) 2007-07-25 EP disclosed
US-6635655-B1 Agonists or antagonists of peroxisome proliferator-activated receptors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-10-21 US disclosed