SCHEMBL9527478

SCHEMBL9527478

COC(=O)c1ccc(Cc2cn(C)c3ccc(C(OC(C)=O)C4CCN(C)C4=O)cc23)c(OC)c1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.43
EPHX2 P34913 7/20 0.43
PPARG P37231 7/20 0.43
CYSLTR2 Q9NS75 2/20 0.42

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
SCHEMBL9526279 0.91 CYSLTR1 (0.42) CYSLTR1EPHX2PPARGCYSLTR2
SCHEMBL9526601 0.91 CYSLTR2 (0.50) CYSLTR1CYSLTR2
SCHEMBL9527925 0.89 CYSLTR1 (0.46) CYSLTR1EPHX2PPARGCYSLTR2
SCHEMBL9526810 0.87 CYSLTR2 (0.51) CYSLTR1CYSLTR2
SCHEMBL9527489 0.84 CYSLTR2 (0.49) CYSLTR1CYSLTR2
SCHEMBL9530873 0.84 CYSLTR2 (0.47) CYSLTR1CYSLTR2
SCHEMBL9526620 0.84 CYSLTR2 (0.49) CYSLTR1CYSLTR2
SCHEMBL9526857 0.80 CYSLTR1 (0.44) CYSLTR1EPHX2PPARGCYSLTR2
SCHEMBL9528153 0.80 CYSLTR2 (0.52) CYSLTR1CYSLTR2
SCHEMBL9527769 0.80 CYSLTR1 (0.44) CYSLTR1EPHX2PPARGCYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337767-B1 CYCLIC AMIDES ICI AMERICAS INC. (US) 1993-01-13 EP disclosed
US-5047402-A Leukotriene Antagonists ICI AMERICAS INC. (US) 1991-09-10 US disclosed
EP-0337767-A1 Cyclic amides ICI AMERICAS INC. (US) 1989-10-18 EP disclosed