SCHEMBL5137437

SCHEMBL5137437

CCCCCCCCCCCC(SOS(=O)(=O)O)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 3/20 0.42
▸ ALDH1A1 P00352 2/20 0.39
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ ASAH1 Q13510 2/20 0.37
▸ PRSS1 P07477 1/20 0.37
▸ PRSS2 P07478 1/20 0.37
▸ PRSS3 P35030 1/20 0.37
▸ CSNK1E P49674 1/20 0.37
▸ CTRC Q99895 1/20 0.37
▸ ACER2 Q5QJU3 1/20 0.36
▸ OPRM1 P35372 1/20 0.36
▸ OPRD1 P41143 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ OPRL1 P41146 1/20 0.36

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
SCHEMBL2792350 0.81 HTR2A (0.41) NAAAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL27907190 0.81 HTR2A (0.41) NAAAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL28256515 0.81 HTR2A (0.41) NAAAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL869575 0.75 NAAA (0.44) NAAAALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL15105376 0.75 HTR2A (0.44) NAAAALDH1A1ASAH1CSNK1EACER2
SCHEMBL15105381 0.75 HTR2A (0.44) NAAAALDH1A1ASAH1CSNK1EACER2
SCHEMBL8082717 0.75 HTR2A (0.44) NAAAALDH1A1ASAH1CSNK1EACER2
SCHEMBL9712083 0.75 NAAA (0.45) NAAAALDH1A1NPC1RAB9ASMN1; SMN2
Sulfuric Acid SCHEMBL28797650 0.74 SIGMAR1 (0.50) NAAAASAH1CSNK1E
SCHEMBL9712067 0.74 NAAA (0.44) NAAAALDH1A1NPC1RAB9ASMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7417084-B2 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY (US) 2008-08-26 — — US claimed
EP-1674292-A1 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-06-28 — — EP claimed
US-20060135660-A1 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY 2006-06-22 — — US claimed
US-7417084-B2 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY (US) 2008-08-26 — — US disclosed
EP-1674292-A1 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY (US) 2006-06-28 — — EP disclosed
US-20060135660-A1 Rubber compound containing an organothiosulfate and a bismaleimide THE GOODYEAR TIRE & RUBBER COMPANY 2006-06-22 — — US disclosed
US-4704334-A ORGANIC THIOSULFATE ADHESION PROMOTERS MONSANTO EUROPE, S.A. (BE) 1987-11-03 — — US disclosed
US-4532080-A Cobalt or nickel salt of organic thiosulfate ester MONSANTO EUROPE, S.A. (BE) 1985-07-30 — — US disclosed
EP-0109955-A2 Rubber/metal composites MONSANTO EUROPE S.A./N.V. (BE) 1984-05-30 — — EP disclosed
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