SCHEMBL8800680

SCHEMBL8800680

NO[C@@H](c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCCC1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.67
HDAC6 Q9UBN7 1/20 0.66

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
SCHEMBL8801130 1.00 ALOX5 (0.67) ALOX5HDAC6
SCHEMBL7234994 0.86 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL8805399 0.86 ALOX5 (0.53) ALOX5HDAC6
SCHEMBL9018914 0.85 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL8799865 0.84 ALOX5 (0.73) ALOX5HDAC6
SCHEMBL8965421 0.84 ALOX5 (0.73) ALOX5HDAC6
SCHEMBL10520188 0.84 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL25992812 0.84 ALOX5 (0.74) ALOX5HDAC6
SCHEMBL8965314 0.83 ALOX5 (0.66) ALOX5HDAC6
SCHEMBL10521151 0.83 ALOX5 (0.69) ALOX5HDAC6

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-0772594-A1 IMINOXYCARBOXYLATES AND DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS Abbott Laboratories (US) 1997-05-14 EP disclosed
WO-1996002507-A1 IMINOXYCARBOXYLATES AND DERIVATIVES AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS ABBOTT LABORATORIES (US) 1996-02-01 WO disclosed