SCHEMBL19337404

SCHEMBL19337404

Cc1cc(CC(=O)Cl)ccc1OCc1ccc2ccccc2n1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 5/20 0.52
FFAR1 O14842 1/20 0.48
AKR1B1 P15121 1/20 0.48
CYSLTR1 Q9Y271 6/20 0.48
GPBAR1 Q8TDU6 4/20 0.47
CYSLTR2 Q9NS75 2/20 0.46

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
SCHEMBL1419915 0.81 ALOX5 (0.72) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL7459197 0.80 CYSLTR1 (0.54) ALOX5CYSLTR1GPBAR1CYSLTR2
SCHEMBL1558372 0.78 CYSLTR1 (0.54) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL1558239 0.78 FFAR1 (0.55) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL9431239 0.78 ALOX5 (0.50) ALOX5FFAR1AKR1B1CYSLTR1CYSLTR2
SCHEMBL9033146 0.77 FFAR1 (0.54) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL9032897 0.77 FFAR1 (0.54) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL9431922 0.76 MEN1 (0.53) ALOX5CYSLTR1CYSLTR2
SCHEMBL9034329 0.76 FFAR1 (0.53) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1
SCHEMBL9034967 0.76 FFAR1 (0.55) ALOX5FFAR1AKR1B1CYSLTR1GPBAR1

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
EP-2297133-B1 1, 2 DISUBSTITUTED HETEROCYCLIC COMPOUNDS FORUM PHARMACEUTICALS INC (US) 2017-09-13 EP disclosed