SCHEMBL7595304

SCHEMBL7595304

CC(O)(c1ccc(OCc2ccc3ccccc3n2)cc1)c1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 8/20 0.66
CYSLTR2 Q9NS75 5/20 0.66
GPBAR1 Q8TDU6 6/20 0.61
ALOX5 P09917 2/20 0.57
PDE10A Q9Y233 3/20 0.57
FFAR1 O14842 1/20 0.56
AKR1B1 P15121 1/20 0.56
ALOX5AP P20292 1/20 0.54

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
SCHEMBL9460524 0.92 CYSLTR1 (0.66) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL22209138 0.87 CYSLTR1 (0.59) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL29587861 0.87 CYSLTR1 (0.59) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL8651397 0.84 CYSLTR1 (0.63) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7593162 0.84 GPBAR1 (0.67) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7599035 0.84 CYSLTR1 (0.62) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7599091 0.83 GPBAR1 (0.65) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7599114 0.83 GPBAR1 (0.65) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7599101 0.82 GPBAR1 (0.60) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL7592902 0.82 GPBAR1 (0.64) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0862557-B1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LAB (US) 2002-11-27 EP claimed
US-5795900-A Symmetrical bis-heteroaryl-methoxy-phenylalkyl carboxylates as inhibitors of leukotriene biosynthesis ABBOTT LABORATORIES (US) 1998-08-18 US claimed
EP-0862557-B1 SYMMETRICAL bis-HETEROARYLMETHOXYPHENYLALKYL CARBOXYLATES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LAB (US) 2002-11-27 EP disclosed
US-5843968-A Symmetrical bis-heteroarylmethoxy-phenylalkyl carboxylates as inhibitors of leukotriene biosynthesis ABBOTT LABORATORIES (US) 1998-12-01 US disclosed
US-5795900-A Symmetrical bis-heteroaryl-methoxy-phenylalkyl carboxylates as inhibitors of leukotriene biosynthesis ABBOTT LABORATORIES (US) 1998-08-18 US disclosed
US-5783586-A Heteroarylmethoxyphenylthioalkyl carboxylates as inhibitors of leukotriene biosynthesis ABBOTT LABORATORIES (US) 1998-07-21 US disclosed