SCHEMBL3575289

SCHEMBL3575289

Cc1c(CCCC(=O)O)c2cccc(C=Cc3ccc(OCC=CCOc4ccc(Cl)cc4)cc3)c2n1CC(=O)O

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 18/20 0.72
CYSLTR1 Q9Y271 18/20 0.72
MCL1 Q07820 1/20 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
SCHEMBL3575282 1.00 CYSLTR2 (0.72) CYSLTR2CYSLTR1MCL1
SCHEMBL3575285 1.00 CYSLTR2 (0.72) CYSLTR2CYSLTR1MCL1
SCHEMBL3563436 0.94 CYSLTR2 (0.78) CYSLTR2CYSLTR1
SCHEMBL3563429 0.94 CYSLTR2 (0.78) CYSLTR2CYSLTR1
SCHEMBL3563434 0.94 CYSLTR2 (0.78) CYSLTR2CYSLTR1
SCHEMBL3562237 0.94 CYSLTR2 (0.68) CYSLTR2CYSLTR1MCL1
SCHEMBL3562240 0.94 CYSLTR2 (0.68) CYSLTR2CYSLTR1MCL1
SCHEMBL3562243 0.94 CYSLTR2 (0.68) CYSLTR2CYSLTR1MCL1
SCHEMBL3561757 0.92 CYSLTR2 (0.65) CYSLTR2CYSLTR1MCL1
SCHEMBL3561752 0.92 CYSLTR2 (0.65) CYSLTR2CYSLTR1MCL1

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
US-7728023-B2 Indole compound and use thereof ONO PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
EP-1852420-A1 INDOLE COMPOUND AND USE THEREOF ONO PHARMACEUTICAL CO., LTD. (JP) 2007-11-07 EP disclosed