SCHEMBL4848359

SCHEMBL4848359

Cc1cccc(COCCCCOCc2ccc3ccccc3n2)c1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 14/20 0.50
GPBAR1 Q8TDU6 5/20 0.50
CYSLTR2 Q9NS75 9/20 0.49

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
SCHEMBL4850064 0.99 CYSLTR1 (0.49) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4841446 0.98 CYSLTR1 (0.47) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27558202 0.94 CYSLTR1 (0.47) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27578321 0.93 CYSLTR1 (0.46) CYSLTR1GPBAR1CYSLTR2
SCHEMBL27557740 0.91 CYSLTR1 (0.44) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4848377 0.89 CYSLTR1 (0.53) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4851712 0.89 CYSLTR1 (0.51) CYSLTR1GPBAR1CYSLTR2
SCHEMBL14045450 0.88 CYSLTR1 (0.45) CYSLTR1GPBAR1CYSLTR2
SCHEMBL4846550 0.88 CYSLTR1 (0.52) CYSLTR1GPBAR1CYSLTR2
SCHEMBL14021730 0.87 MAPT (0.42) 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 6 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 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
US-6635655-B1 Agonists or antagonists of peroxisome proliferator-activated receptors AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-10-21 US disclosed