SCHEMBL6089489

SCHEMBL6089489

Cc1cc(Cl)cc(COc2cccc(OCc3ccc4cc(F)ccc4n3)c2)c1OCC(=O)O

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 16/20 0.51
CYSLTR2 Q9NS75 15/20 0.51
GPBAR1 Q8TDU6 1/20 0.45

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
SCHEMBL6089534 0.91 CYSLTR1 (0.49) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6088840 0.89 CYSLTR1 (0.58) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6087773 0.89 CYSLTR1 (0.52) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7460392 0.85 CYSLTR1 (0.51) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6090141 0.85 CYSLTR1 (0.44) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7460389 0.84 CYSLTR1 (0.50) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6089262 0.81 CYSLTR1 (0.53) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6088777 0.80 CYSLTR1 (0.55) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6088975 0.79 CYSLTR1 (0.46) CYSLTR1CYSLTR2GPBAR1
SCHEMBL6089086 0.79 CYSLTR1 (0.51) CYSLTR1CYSLTR2GPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7005440-B1 Therapeutic uses of tri-aryl acid derivatives AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-02-28 US disclosed