Sugi Predict

Sugi Predict / Compounds / SCHEMBL21635542

SCHEMBL21635542

SCHEMBL21635542

CCOC(=O)C1(C)CC(c2cc(N)c(F)cc2Cl)=NO1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 4/20 0.39
▸ CA2 P00918 4/20 0.39
▸ F10 P00742 1/20 0.36
▸ ITGB1 P05556 4/20 0.35
▸ ITGA4 P13612 4/20 0.35
▸ SSTR5 P35346 1/20 0.34
▸ KMT2A Q03164 4/20 0.32
▸ MEN1 O00255 3/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ HPGD P15428 2/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ GAA P10253 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
SCHEMBL29769188 1.00 CA1 (0.39) CA1CA2F10ITGB1ITGA4
SCHEMBL23246113 1.00 CA1 (0.39) CA1CA2F10ITGB1ITGA4
SCHEMBL30728606 1.00 CA1 (0.39) CA1CA2F10ITGB1ITGA4
SCHEMBL29769216 1.00 CA1 (0.39) CA1CA2F10ITGB1ITGA4
SCHEMBL30899560 0.90 F10 (0.40) CA1CA2F10ITGB1ITGA4
SCHEMBL22714488 0.90 F10 (0.40) CA1CA2F10ITGB1ITGA4
SCHEMBL29712909 0.88 CA1 (0.42) CA1CA2F10ITGB1ITGA4
SCHEMBL24485235 0.88 CA1 (0.42) CA1CA2F10ITGB1ITGA4
SCHEMBL24484705 0.86 CA1 (0.35) CA1CA2F10ITGB1ITGA4
SCHEMBL29712888 0.86 CA1 (0.35) CA1CA2F10ITGB1ITGA4

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 26 patents — showing the first 20. 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
CN-113880774-B Preparation method of phenyl isoxazoline compound 沈阳中化农药化工研发有限公司 2023-12-08 — — CN disclosed
EP-3976603-B1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-11-15 — — EP disclosed
EP-3976603-B1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-11-15 — — EP disclosed
EP-4177250-A1 PREPARATION METHOD FOR PHENYLISOXAZOLINE COMPOUND Shenyang Sinochem Agrochemicals R & D Co., Ltd. (CN) 2023-05-10 — — EP disclosed
US-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2023-02-23 — — US disclosed
US-20220402903-A1 ISOXAZOLINE COMPOUND WITH OPTICAL ACTIVITY AND USE SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2022-12-22 — — US disclosed
CN-115462385-A Herbicidal composition containing phenyl isoxazolines with optical activity and application 沈阳中化农药化工研发有限公司 2022-12-13 — — CN disclosed
WO-2021139498-A1 ISOXAZOLINE OXIME CARBOXYLATE COMPOUND, PREPARATION METHOD THEREFOR, AND HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2021-07-15 — — WO disclosed
CN-112745305-A Triazinone compound and application thereof 沈阳中化农药化工研发有限公司 2021-05-04 — — CN disclosed
CN-112690283-A Herbicidal composition containing phenyl isoxazolines with optical activity and application 沈阳中化农药化工研发有限公司 2021-04-23 — — CN disclosed
WO-2021073487-A1 ISOXAZOLINE COMPOUND HAVING OPTICAL ACTIVITY AND USE THEREOF 沈阳中化农药化工研发有限公司 2021-04-22 — — WO disclosed
CN-112679488-A Isoxazoline compound with optical activity and application thereof 沈阳中化农药化工研发有限公司 2021-04-20 — — CN disclosed
WO-2020239607-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-12-03 — — WO disclosed
WO-2020239607-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-12-03 — — WO disclosed
CN-105753853-B Isoxazoline-containing uracil compound and application thereof 沈阳中化农药化工研发有限公司 2020-08-04 — — CN disclosed
CN-106536517-B Isoxazoline-containing uracil compound and application thereof 沈阳中化农药化工研发有限公司 2020-03-17 — — CN disclosed
US-10550111-B2 Pyrimidine urea compound containing isoxazolines and use thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2020-02-04 — — US 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 (4 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-20220402903-A1 ISOXAZOLINE COMPOUND WITH OPTICAL ACTIVITY AND USE CYP4X1, AGXT, GYS2 CA1 1459/4885CA2 557/4885F10 4265/4885
US-10550111-B2 Pyrimidine urea compound containing isoxazolines and use thereof DDX6, OAT, DHX36 CA1 3124/4885CA2 3606/4885F10 4124/4885
US-12202821-B2 Herbicidal compounds DDT, ACHE, GSTO1 CA1 677/4885CA2 257/4885F10 4732/4885
US-20230053699-A1 SUBSTITUTED-ISOXAZOLINE-CONTAINING AROMATIC COMPOUND, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF CYP4X1, CYP4F11, CBR3 CA1 2258/4885CA2 1086/4885F10 2779/4885

“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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