SCHEMBL5266732

SCHEMBL5266732

Cc1c(CCCC(=O)O)c2cccc(C=Cc3ccc(OCCCCOc4ccccc4)cc3)c2n1CC(=O)O

nearest known ligand 0.90

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 19/20 0.90
CYSLTR1 Q9Y271 19/20 0.90
PPARA Q07869 1/20 0.52

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
SCHEMBL5266726 1.00 CYSLTR2 (0.90) CYSLTR2CYSLTR1PPARA
SCHEMBL3622042 0.94 CYSLTR2 (0.83) CYSLTR2CYSLTR1PPARA
SCHEMBL3622044 0.94 CYSLTR2 (0.83) CYSLTR2CYSLTR1PPARA
SCHEMBL3563429 0.93 CYSLTR2 (0.78) CYSLTR2CYSLTR1PPARA
SCHEMBL3563434 0.93 CYSLTR2 (0.78) CYSLTR2CYSLTR1PPARA
SCHEMBL3563436 0.93 CYSLTR2 (0.78) CYSLTR2CYSLTR1PPARA
SCHEMBL3567214 0.92 CYSLTR2 (0.81) CYSLTR2CYSLTR1PPARA
SCHEMBL3567209 0.92 CYSLTR2 (0.81) CYSLTR2CYSLTR1PPARA
SCHEMBL3563171 0.92 CYSLTR2 (0.80) CYSLTR2CYSLTR1
SCHEMBL3570636 0.92 CYSLTR2 (0.80) CYSLTR2CYSLTR1PPARA

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-1852420-B1 Indole compounds for treating respiratory disorders ONO PHARMACEUTICAL CO (JP) 2012-10-17 EP disclosed
EP-1852420-A1 INDOLE COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-07 EP disclosed