SCHEMBL1397153

SCHEMBL1397153

C=C(C)c1ccccc1CCC[C@H](C(=O)O)c1cccc(/C=C/c2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 1/20 0.51
▸ CYSLTR1 Q9Y271 1/20 0.51

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
SCHEMBL18192993 0.88 CYSLTR2 (0.48) CYSLTR2CYSLTR1
SCHEMBL1397624 0.85 CYSLTR1 (0.53) CYSLTR2CYSLTR1
SCHEMBL9947884 0.85 — —
SCHEMBL12597691 0.85 — —
SCHEMBL1396913 0.85 — —
SCHEMBL13971703 0.85 — —
SCHEMBL1396780 0.85 — —
SCHEMBL10027690 0.85 — —
SCHEMBL1397230 0.85 — —
Hydrochloric Acid SCHEMBL14670343 0.84 — —

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-2288595-A2 AN IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF Aptuit Laurus Pvt Limited (IN) 2011-03-02 — — EP disclosed
WO-2009144742-A2 AN IMPROVED PROCESS FOR PREPARING MONTELUKAST AND SALTS THEREOF APTUIT LAURUS PVT LIMITED (IN) 2009-12-03 — — WO disclosed
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