SCHEMBL4883230

SCHEMBL4883230

CCCCC(CC)COC(=O)COc1ccc(Cl)cc1C

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.81
▸ MAPK1 P28482 1/20 0.81
▸ TDP1 Q9NUW8 4/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ MAPT P10636 2/20 0.50
▸ ESR1 P03372 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ ESR2 Q92731 1/20 0.50
▸ CTDSP1 Q9GZU7 1/20 0.50
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ TSHR P16473 1/20 0.48
▸ ATM Q13315 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ CA2 P00918 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
SCHEMBL29510436 1.00 ALDH1A1 (0.81) ALDH1A1MAPK1TDP1L3MBTL1CYP1A2
SCHEMBL5933385 0.90 ALDH1A1 (1.00) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL29394502 0.90 ALDH1A1 (1.00) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL21887695 0.84 ALDH1A1 (0.81) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL29777555 0.82 ALDH1A1 (0.58) ALDH1A1MAPK1TDP1MAPTPOLB
SCHEMBL6440730 0.82 ALDH1A1 (0.58) ALDH1A1MAPK1TDP1MAPTPOLB
SCHEMBL4884515 0.82 ALDH1A1 (0.78) ALDH1A1MAPK1TDP1L3MBTL1CYP1A2
SCHEMBL5933782 0.81 ALDH1A1 (0.77) ALDH1A1MAPK1TDP1L3MBTL1MAPT
SCHEMBL4883831 0.80 TDP1 (0.62) ALDH1A1MAPK1TDP1L3MBTL1CYP1A2
SCHEMBL29435277 0.80 TDP1 (0.62) ALDH1A1MAPK1TDP1L3MBTL1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20080242544-A1 Phytoactive Composition MICAP PLC (GB) 2008-10-02 — — US claimed
US-20250024837-A1 PESTICIDE SYSTEM BANISH, MICHELE 2025-01-23 — — US disclosed
US-20240349719-A1 HIGHLY LOADED BROMOXYNIL FORMULATIONS Adama Australia Pty Limited (AU) 2024-10-24 — — US disclosed
US-20240327359-A1 3-ISOXAZOLIDINONE COMPOUND, PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUND CO., LTD. (CN) 2024-10-03 — — US disclosed
CN-118368981-A High-load bromoxynil formulation 安道麦澳大利亚私人有限公司 2024-07-19 — — CN disclosed
EP-4378314-A2 HERBICIDAL COMPOSITIONS Bayer AG (DE) 2024-06-05 — — EP disclosed
WO-2024099118-A1 OXABICYCLOALKANE COMPOUNDS, PREPARATION METHOD THEREFOR, AND HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2024-05-16 — — WO disclosed
CN-118005577-A Oxabiscycloalkane compound and preparation method thereof, weeding composition and application 青岛清原化合物有限公司 2024-05-10 — — CN disclosed
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 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
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
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-20080242544-A1 Phytoactive Composition MICAP PLC (GB) 2008-10-02 — — US disclosed
US-20070135307-A1 Inhibition of tuber sprouting ACETO AGRICULTURAL CHEMICALS CORP. (US) 2007-06-14 — — US disclosed
WO-2007044200-A2 INHIBITION OF TUBER SPROUTING ACETO AGRICULTURAL CHEMICALS CORPORATION (US) 2007-04-19 — — WO disclosed
EP-1750504-A1 PHYTOACTIVE COMPOSITION MICAP PLC. (GB) 2007-02-14 — — EP disclosed
WO-2005102045-A1 PHYTOACTIVE COMPOSITION MICAP PLC (GB) 2005-11-03 — — 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 (5 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-20070135307-A1 Inhibition of tuber sprouting PF4, PDGFA, PDGFRB ALDH1A1 3374/4885MAPK1 2229/4885TDP1 2960/4885
US-20080242544-A1 Phytoactive Composition PNMT, ACHE, TACR1 ALDH1A1 1553/4885MAPK1 3708/4885TDP1 2681/4885
US-20240327359-A1 3-ISOXAZOLIDINONE COMPOUND, PREPARATION METHOD, HERBICIDAL COMPOSITION AND APPLICATION THEREOF CYP4X1, GLRX3, CYP4Z1 ALDH1A1 829/4885MAPK1 4585/4885TDP1 2130/4885
US-20250024837-A1 PESTICIDE SYSTEM ACHE, PFAS, FPGS ALDH1A1 3501/4885MAPK1 4191/4885TDP1 100/4885
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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