SCHEMBL9076482

SCHEMBL9076482

COC1(c2csc(S(=O)(=O)c3ccc4c(c3)CCC4=NO)c2)CCOC1C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.33
HTT P42858 1/20 0.31
BRAF P15056 1/20 0.30

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
SCHEMBL9076479 1.00 ALOX5 (0.33) ALOX5HTTBRAF
SCHEMBL9076534 0.82 ALOX5 (0.37) ALOX5HTTBRAF
SCHEMBL9076533 0.82 ALOX5 (0.37) ALOX5HTTBRAF
SCHEMBL9076538 0.82 ALOX5 (0.37) ALOX5HTTBRAF
SCHEMBL9076849 0.80 HTT (0.33) ALOX5HTTBRAF
SCHEMBL9077130 0.80 HTT (0.33) ALOX5HTTBRAF
SCHEMBL9077136 0.80 HTT (0.33) ALOX5HTTBRAF
SCHEMBL9076846 0.80 HTT (0.33) ALOX5HTTBRAF
SCHEMBL9077133 0.80 HTT (0.33) ALOX5HTTBRAF
SCHEMBL9048977 0.74 ALOX5 (0.41) ALOX5

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
US-5482966-A LIPOXYGENASE ENZYME INHIBITORS AS ANTIINFLAMMATORY AGENTS ZENECA LIMITED (GB) 1996-01-09 US disclosed
US-5332757-A Enzyme inhibitors ZENECA LIMITED (GB) 1994-07-26 US disclosed
EP-0555068-A1 Oxime derivatives as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1993-08-11 EP disclosed