SCHEMBL9076533

SCHEMBL9076533

COC1(c2csc(S(=O)(=O)c3ccc4c(c3)CC/C4=N\O)c2)CCOCC1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.37
HTT P42858 1/20 0.33
BRAF P15056 3/20 0.33
MAPK3 P27361 2/20 0.31
MAPK1 P28482 2/20 0.31

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
SCHEMBL9076538 1.00 ALOX5 (0.37) ALOX5HTTBRAFMAPK3MAPK1
SCHEMBL9076534 1.00 ALOX5 (0.37) ALOX5HTTBRAFMAPK3MAPK1
SCHEMBL9076479 0.82 ALOX5 (0.33) ALOX5HTTBRAF
SCHEMBL9076482 0.82 ALOX5 (0.33) ALOX5HTTBRAF
SCHEMBL9075721 0.81 ALOX5 (0.37) ALOX5
SCHEMBL9075712 0.81 ALOX5 (0.37) ALOX5
SCHEMBL9075716 0.81 ALOX5 (0.37) ALOX5
SCHEMBL9074253 0.78 ALOX5 (0.44) ALOX5HTTBRAFMAPK3MAPK1
SCHEMBL9074251 0.78 ALOX5 (0.44) ALOX5HTTBRAFMAPK3MAPK1
SCHEMBL9074257 0.78 ALOX5 (0.44) ALOX5HTTBRAFMAPK3MAPK1

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
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