SCHEMBL8965314

SCHEMBL8965314

NOC[C@@H](c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCC1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.66
HDAC6 Q9UBN7 1/20 0.64

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
SCHEMBL8799890 0.87 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL8965126 0.87 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL9018914 0.84 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL8800680 0.83 ALOX5 (0.67) ALOX5HDAC6
SCHEMBL8801130 0.83 ALOX5 (0.67) ALOX5HDAC6
SCHEMBL7234994 0.83 ALOX5 (0.70) ALOX5HDAC6
SCHEMBL10521151 0.82 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL8801108 0.82 ALOX5 (0.69) ALOX5HDAC6
SCHEMBL9303045 0.81 ALOX5 (0.66) ALOX5HDAC6
SCHEMBL8799865 0.81 ALOX5 (0.73) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512581-A ANTIINFLAMMATORY AGENT ABBOTT LABORATORIES (US) 1996-04-30 US disclosed