SCHEMBL22714399

SCHEMBL22714399

CCOC(=O)C1(C)CC(c2cc(N)ccc2Cl)=NO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 1/20 0.39
▸ CA1 P00915 4/20 0.37
▸ CA2 P00918 4/20 0.37
▸ ITGB1 P05556 3/20 0.36
▸ ITGA4 P13612 3/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ HTT P42858 1/20 0.33

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
SCHEMBL30899566 1.00 F10 (0.39) F10CA1CA2ITGB1ITGA4
SCHEMBL30899560 0.85 F10 (0.40) F10CA1CA2ITGB1ITGA4
SCHEMBL22714488 0.85 F10 (0.40) F10CA1CA2ITGB1ITGA4
SCHEMBL22714373 0.85 NPSR1 (0.40) SMN1; SMN2MEN1MAPTKMT2AKDM4E
SCHEMBL30899559 0.85 NPSR1 (0.40) SMN1; SMN2MEN1MAPTKMT2AKDM4E
SCHEMBL22714354 0.84 MAPK1 (0.37) F10CA1CA2ITGB1ITGA4
SCHEMBL30899568 0.84 MAPK1 (0.37) F10CA1CA2ITGB1ITGA4
SCHEMBL23246113 0.83 CA1 (0.39) F10CA1CA2ITGB1ITGA4
SCHEMBL21635542 0.83 CA1 (0.39) F10CA1CA2ITGB1ITGA4
SCHEMBL29769188 0.83 CA1 (0.39) F10CA1CA2ITGB1ITGA4

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
US-12202821-B2 Herbicidal compounds SYNGENTA CROP PROTECTION AG (CH) 2025-01-21 — — US 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
US-20220227744-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-07-21 — — US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220227744-A1 HERBICIDAL COMPOUNDS DDT, ACHE, GSTO1 F10 4732/4885CA1 677/4885CA2 257/4885
US-12202821-B2 Herbicidal compounds DDT, ACHE, GSTO1 F10 4732/4885CA1 677/4885CA2 257/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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