SCHEMBL5933385

SCHEMBL5933385

CCCCC(CC)COC(=O)COc1ccc(Cl)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 1.00
▸ MAPK1 P28482 1/20 1.00
▸ TDP1 Q9NUW8 5/20 0.68
▸ L3MBTL1 Q9Y468 2/20 0.68
▸ MAPT P10636 4/20 0.60
▸ TSHR P16473 3/20 0.49
▸ CYP3A4 P08684 2/20 0.49
▸ ATM Q13315 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ PKM P14618 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ LMNA P02545 1/20 0.46

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
SCHEMBL29394502 1.00 ALDH1A1 (1.00) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL4883230 0.90 ALDH1A1 (0.81) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL21887695 0.90 ALDH1A1 (0.81) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL29510436 0.90 ALDH1A1 (0.81) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL29544082 0.89 ALDH1A1 (0.80) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL5933782 0.87 ALDH1A1 (0.77) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL18583204 0.86 ALDH1A1 (0.76) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL29729468 0.85 ALDH1A1 (0.73) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL11256068 0.84 ALDH1A1 (0.71) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL15810368 0.81 ALDH1A1 (0.69) ALDH1A1MAPK1TDP1L3MBTL1MAPT

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 230 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4699442-A1 HERBICIDE COMPOSITION AND METHOD FOR PREPARING THEREOF Pestila Sp. z o.o. (PL) 2026-02-25 — — EP claimed
EP-4337017-A1 HERBICIDE/SAFENER COMBINATION BASED ON SAFENERS FROM THE CLASS OF SUBSTITUTED [(1,5-DIPHENYL-1H-1,2,4-TRIAZOL-3-YL)OXY]ACETIC ACIDS AND THEIR SALTS Bayer Aktiengesellschaft (DE) 2024-03-20 — — EP claimed
WO-2022152728-A1 HERBICIDAL COMPOSITIONS BAYER AKTIENGESELLSCHAFT (DE) 2022-07-21 — — WO claimed
CN-112305131-B GC-Orbitrap-MS screening and analyzing method for pesticide residues in animal derived food 中国农业科学院农业质量标准与检测技术研究所 2021-09-21 — — CN claimed
CN-113292393-A Method for synthesizing alpha, alpha-dideuterol and deuterated drugs by reducing and deuterating acyl fluoride compounds 中国农业大学 2021-08-24 — — CN claimed
CN-110087467-B Herbicidal combination 拜耳作物科学股份公司 2021-08-13 — — CN claimed
CN-112305131-A GC-Orbitrap-MS screening and analyzing method for pesticide residues in animal derived food 中国农业科学院农业质量标准与检测技术研究所 2021-02-02 — — CN claimed
CN-111787799-A Method for reducing crop damage 拜耳公司 2020-10-16 — — CN claimed
CN-111770684-A Method for reducing crop damage 拜耳公司 2020-10-13 — — CN claimed
CN-111757672-A Method for reducing crop damage 拜耳公司 2020-10-09 — — CN claimed
CN-111741679-A Method for reducing crop damage 拜耳公司 2020-10-02 — — CN claimed
EP-4699442-A1 HERBICIDE COMPOSITION AND METHOD FOR PREPARING THEREOF Pestila Sp. z o.o. (PL) 2026-02-25 — — EP disclosed
EP-4699442-A1 HERBICIDE COMPOSITION AND METHOD FOR PREPARING THEREOF Pestila Sp. z o.o. (PL) 2026-02-25 — — EP disclosed
EP-4617275-A1 OXABICYCLOALKANE COMPOUNDS, PREPARATION METHOD THEREFOR, AND HERBICIDAL COMPOSITION AND USE THEREOF Qingdao KingAgroot Chemical Compound Co., Ltd. (CN) 2025-09-17 — — EP disclosed
US-12325646-B2 Fertigation water treatment UNIVERSITY OF GUELPH (CA) 2025-06-10 — — US disclosed
US-20140031214-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR A DERIVATIVE THEREOF AND SYNTHETIC AUXIN HERBICIDES DOW AGROSCIENCES LLC (US) 2014-01-30 — — US disclosed
US-20140031214-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR A DERIVATIVE THEREOF AND SYNTHETIC AUXIN HERBICIDES DOW AGROSCIENCES LLC (US) 2014-01-30 — — US disclosed
WO-2014018403-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID DOW AGROSCIENCES LLC (US) 2014-01-30 — — WO disclosed
WO-2013174833-A1 CHEMICAL STABILIZATION OF IODOSULFURON-METHYL SODIUM SALT BY HYDROXYSTEARATES BAYER CROPSCIENCE AG (DE) 2013-11-28 — — WO disclosed
US-20060276339-A1 Methods and compositions for increasing the efficacy of biologically-active ingredients BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2006-12-07 — — 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 (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-20060276339-A1 Methods and compositions for increasing the efficacy of biologically-active ingredients ENPP1, ENPP3, SMPD1 ALDH1A1 2504/4885MAPK1 3407/4885TDP1 696/4885
US-20140031214-A1 HERBICIDAL COMPOSITIONS COMPRISING 4-AMINO-3-CHLORO-5-FLUORO-6-(4-CHLORO-2-FLUORO-3-METHOXYPHENYL) PYRIDINE-2-CARBOXYLIC ACID OR A DERIVATIVE THEREOF AND SYNTHETIC AUXIN HERBICIDES DDT, HPD, P4HTM ALDH1A1 2084/4885MAPK1 1561/4885TDP1 3815/4885

“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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