SCHEMBL9031804

SCHEMBL9031804

O=C(O)Cc1ccc(OCc2ccc3ccccc3n2)c(F)c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.55
AKR1B1 P15121 1/20 0.55
CYSLTR1 Q9Y271 7/20 0.52
CYSLTR2 Q9NS75 5/20 0.52
PDE10A Q9Y233 1/20 0.52
PPARG P37231 1/20 0.52
GPBAR1 Q8TDU6 3/20 0.51
ALOX5 P09917 3/20 0.50

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
SCHEMBL6584268 0.94 FFAR1 (0.60) FFAR1AKR1B1CYSLTR1CYSLTR2PPARG
SCHEMBL9581742 0.89 FFAR1 (0.68) FFAR1AKR1B1CYSLTR1CYSLTR2PDE10A
SCHEMBL9430587 0.88 ALOX5 (0.50) CYSLTR1PDE10APPARGALOX5
SCHEMBL9034967 0.86 FFAR1 (0.55) FFAR1AKR1B1CYSLTR1CYSLTR2GPBAR1
SCHEMBL1558239 0.86 FFAR1 (0.55) FFAR1AKR1B1CYSLTR1CYSLTR2GPBAR1
SCHEMBL9430772 0.85 FFAR1 (0.52) FFAR1AKR1B1CYSLTR1CYSLTR2PPARG
SCHEMBL9032897 0.85 FFAR1 (0.54) FFAR1AKR1B1CYSLTR1CYSLTR2PPARG
SCHEMBL9033146 0.85 FFAR1 (0.54) FFAR1AKR1B1CYSLTR1CYSLTR2PDE10A
SCHEMBL3271474 0.84 GPBAR1 (0.67) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5
SCHEMBL9034329 0.84 FFAR1 (0.53) FFAR1AKR1B1CYSLTR1CYSLTR2PPARG

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-0499926-B1 2-Substituted quinolines, process for their preparation as well as their use in medicaments BAYER AG (DE) 1996-09-11 EP disclosed
US-5304563-A Lipoxygenase inhibitors BAYER AKTIENGESELLSCHAFT (DE) 1994-04-19 US disclosed
EP-0499926-A1 2-Substituted quinolines, process for their preparation as well as their use in medicaments BAYER AG (DE) 1992-08-26 EP disclosed