SCHEMBL7599646

SCHEMBL7599646

CC(C)(CON=CC(=O)O)C(c1ccc(OCc2ccc3ccccc3n2)cc1)c1ccc(OCc2ccc3ccccc3n2)cc1.[NaH]

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 16/20 0.65
GPBAR1 Q8TDU6 1/20 0.52
ALOX5AP P20292 1/20 0.51
HDAC6 Q9UBN7 1/20 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
SCHEMBL7599624 0.99 ALOX5 (0.66) ALOX5GPBAR1ALOX5APHDAC6
SCHEMBL7599641 0.90 ALOX5 (0.55) ALOX5GPBAR1ALOX5AP
SCHEMBL7594537 0.85 ALOX5 (0.72) ALOX5GPBAR1HDAC6
SCHEMBL7594855 0.84 ALOX5 (0.73) ALOX5GPBAR1HDAC6
SCHEMBL8690534 0.83 ALOX5 (0.54) ALOX5GPBAR1ALOX5APHDAC6
SCHEMBL8555093 0.82 ALOX5 (0.71) ALOX5GPBAR1HDAC6
SCHEMBL8688835 0.82 ALOX5 (0.54) ALOX5GPBAR1ALOX5APHDAC6
SCHEMBL8890266 0.82 ALOX5 (0.67) ALOX5GPBAR1
SCHEMBL8555241 0.81 ALOX5 (0.72) ALOX5GPBAR1HDAC6
SCHEMBL7599636 0.81 ALOX5 (0.55) ALOX5GPBAR1ALOX5APHDAC6

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-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