SCHEMBL9746290

SCHEMBL9746290

CCOC(=O)Nc1ccccc1CC=Cc1cccc(OCc2ccc3ccc(Cl)cc3n2)c1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CYSLTR2 Q9NS75 8/20 0.47
▸ CYSLTR1 Q9Y271 8/20 0.47

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
SCHEMBL9203196 0.91 CYSLTR1 (0.50) CYSLTR2CYSLTR1
SCHEMBL9203199 0.91 CYSLTR1 (0.50) CYSLTR2CYSLTR1
SCHEMBL9747317 0.86 ALDH1A1 (0.37) CYSLTR2CYSLTR1
SCHEMBL9119725 0.83 CYSLTR1 (0.51) CYSLTR2CYSLTR1
SCHEMBL9119729 0.83 CYSLTR1 (0.51) CYSLTR2CYSLTR1
SCHEMBL9210757 0.82 CYSLTR2 (0.50) CYSLTR2CYSLTR1
SCHEMBL9119519 0.81 CYSLTR1 (0.49) CYSLTR2CYSLTR1
SCHEMBL9119515 0.81 CYSLTR1 (0.49) CYSLTR2CYSLTR1
SCHEMBL9746294 0.80 CYSLTR1 (0.47) CYSLTR2CYSLTR1
SCHEMBL9209846 0.80 CYSLTR1 (0.47) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104882-A Leukotriene antagonists MERCK FROSST CANADA, INC. (CA) 1992-04-14 — — US disclosed
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