SCHEMBL22714370

SCHEMBL22714370

CCOC(=O)C1(C)CC(c2cc(-n3c(=O)n(C)c(=S)n(C)c3=O)c(Cl)cc2Cl)=NO1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 1/20 0.30
▸ KCNH2 Q12809 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ CA1 P00915 1/20 0.30
▸ CA2 P00918 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL29438148 1.00 OPRL1 (0.30) OPRL1KCNH2OPRM1CA1CA2
SCHEMBL30958994 1.00 OPRL1 (0.30) OPRL1KCNH2OPRM1CA1CA2
SCHEMBL29438147 1.00 OPRL1 (0.30) OPRL1KCNH2OPRM1CA1CA2
SCHEMBL25061578 0.92 CA1 (0.33) CA1CA2
SCHEMBL22714357 0.92 CA1 (0.33) CA1CA2
SCHEMBL25061571 0.92 CA1 (0.33) CA1CA2
SCHEMBL29438151 0.92 CA1 (0.33) CA1CA2
SCHEMBL22714360 0.87 CA1 (0.33) CA1CA2
SCHEMBL29438146 0.87 CA1 (0.33) CA1CA2
SCHEMBL22714406 0.86 MAPK1 (0.34) KCNH2OPRM1CA1CA2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024110366-A1 A METHOD FOR CONTROLLING WEEDS SYNGENTA CROP PROTECTION AG (CH) 2024-05-30 — — WO claimed
WO-2024110366-A1 A METHOD FOR CONTROLLING WEEDS SYNGENTA CROP PROTECTION AG (CH) 2024-05-30 — — WO disclosed
CN-118084888-A Herbicidal compounds 先正达农作物保护股份公司 2024-05-28 — — CN disclosed
CN-113874368-B Herbicidal compounds 先正达农作物保护股份公司 2024-03-08 — — CN disclosed
EP-3976603-B1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-11-15 — — EP disclosed
EP-3976603-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2022-04-06 — — EP disclosed
CN-113874368-A Herbicidal compounds 先正达农作物保护股份公司 2021-12-31 — — CN disclosed
WO-2020239607-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-12-03 — — WO disclosed
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