SCHEMBL8554761

SCHEMBL8554761

O=C(O)c1ccccc1CCC(O)c1cccc(C=Cc2ccc3sc(Cl)c(Cl)c3n2)c1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 15/20 0.58
▸ CYSLTR1 Q9Y271 15/20 0.58

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
SCHEMBL8554758 1.00 CYSLTR2 (0.58) CYSLTR2CYSLTR1
SCHEMBL8595799 0.85 CYSLTR2 (0.55) CYSLTR2CYSLTR1
SCHEMBL8595801 0.85 CYSLTR2 (0.55) CYSLTR2CYSLTR1
SCHEMBL8595806 0.85 CYSLTR2 (0.55) CYSLTR2CYSLTR1
SCHEMBL11969735 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1
SCHEMBL3356855 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1
SCHEMBL692812 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1
SCHEMBL4300160 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1
SCHEMBL692811 0.81 CYSLTR2 (0.57) CYSLTR2CYSLTR1
Water SCHEMBL3030652 0.80 CYSLTR2 (0.56) CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0840728-A1 HETEROARYL DIOL ACIDS AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (CA) 1998-05-13 — — EP disclosed
WO-1996040638-A1 HETEROARYL DIOL ACIDS AS LEUKOTRIENE ANTAGONISTS MERCK FROSST CANADA INC. (US) 1996-12-19 — — WO disclosed
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