SCHEMBL8669643

SCHEMBL8669643

O=C(O)CCCCc1ccc(OCc2ccc3cc(F)ccc3n2)cc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 10/20 0.72
CYSLTR2 Q9NS75 6/20 0.72
FFAR1 O14842 2/20 0.60
AKR1B1 P15121 1/20 0.60
ALOX5 P09917 1/20 0.49
FFAR4 Q5NUL3 1/20 0.48

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
SCHEMBL8646512 0.84 CYSLTR1 (1.00) CYSLTR1CYSLTR2FFAR1AKR1B1
SCHEMBL8650159 0.81 CYSLTR1 (0.74) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL7594815 0.79 CYSLTR2 (0.49) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL7599131 0.78 CYSLTR2 (0.49) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL7599144 0.78 CYSLTR2 (0.49) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL9460404 0.77 ALOX5 (0.72) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL2566640 0.77 CYSLTR2 (0.56) CYSLTR1CYSLTR2ALOX5
SCHEMBL7604022 0.77 ALOX5 (0.57) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5
SCHEMBL2564677 0.75 PDE10A (0.54) CYSLTR1CYSLTR2ALOX5
SCHEMBL14021559 0.75 CYSLTR1 (1.00) CYSLTR1CYSLTR2FFAR1AKR1B1ALOX5

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-0862557-A1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS Abbott Laboratories (US) 1998-09-09 EP disclosed
WO-1997012867-A1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1997-04-10 WO disclosed