SCHEMBL437160

SCHEMBL437160

C=CCC(C)[N+](C)(C)C(C)(Cc1ccccc1)C(=O)[O-]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALPL P05186 1/20 0.38
POLB P06746 1/20 0.38
ALPG P10696 1/20 0.38
TRPA1 O75762 1/20 0.36
MMP2 P08253 7/20 0.35
MMP3 P08254 7/20 0.35
MMP7 P09237 6/20 0.35
MMP1 P03956 5/20 0.34
MMP8 P22894 2/20 0.34
ADAM17 P78536 1/20 0.34
MMP9 P14780 1/20 0.34
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
MMP14 P50281 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 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
SCHEMBL609004 0.78 BBOX1 (0.31)
SCHEMBL278738 0.73 BBOX1 (0.33)
SCHEMBL4560419 0.70 BBOX1 (0.31)
Acetic Acid SCHEMBL6526415 0.70 BBOX1 (0.31)
SCHEMBL7580357 0.69 BBOX1 (0.33)
SCHEMBL18315182 0.67 ALPL (0.48) CYP2C19CYP3A4ALDH1A1CYP2C9ALPL
Hydrochloric Acid SCHEMBL2841545 0.65 ALDH1A1 (0.47) CYP2C19ALDH1A1MMP2MMP3MMP7
SCHEMBL21269779 0.64 MMP8 (0.50) CYP2C19CYP3A4ALDH1A1CYP2C9ALPL
SCHEMBL21269751 0.64 MMP8 (0.50) CYP2C19CYP3A4ALDH1A1CYP2C9ALPL
SCHEMBL21269984 0.64 MMP8 (0.50) CYP2C19CYP3A4ALDH1A1CYP2C9ALPL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117693500-A Carboxamide derivative and agricultural/horticultural plant disease control agent 组合化学工业株式会社 2024-03-12 CN disclosed
US-20240065267-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2024-02-29 US disclosed
US-20240049723-A1 PLANT GROWTH REGULATOR OR METHOD FOR PROMOTING PLANT GROWTH KUREHA CORPORATION (JP) 2024-02-15 US disclosed
EP-4275496-A1 PLANT GROWTH REGULATOR AND METHOD FOR PROMOTING PLANT GROWTH Kureha Corporation (JP) 2023-11-15 EP disclosed
US-11805779-B2 Plant disease control composition and method for controlling plant disease by applying the same MITSUI CHEMICALS CROP & LIFE SOLUTIONS, INC. (JP) 2023-11-07 US disclosed
CN-111683930-B Novel isoxazole compound or salt thereof 日本欧爱特农业科技株式会社 2023-06-27 CN disclosed
CN-115135150-A Pesticide granule composition for rice seedling raising box with reduced phytotoxicity 日商拜耳作物科学股份有限公司 2022-09-30 CN disclosed
CN-110325040-B Plant disease control composition and method for controlling plant disease using same 三井化学AGRO株式会社 2022-04-05 CN disclosed
CN-113891655-A Plant parasitic nematode control agent and method for controlling plant parasitic nematode 明治制果药业株式会社 2022-01-04 CN disclosed
CN-113163766-A Pest control agent composition and method of use thereof 日本农药株式会社 2021-07-23 CN disclosed
US-9288986-B2 Plant disease control composition and method for controlling plant disease by applying the same MITSUI CHEMICALS AGRO, INC. (JP) 2016-03-22 US disclosed
EP-2580962-A1 Plant disease and insect damage control composition and plant disease and insect damage prevention method MITSUI CHEMICALS AGRO, INC. (JP) 2013-04-17 EP disclosed
US-20120282349-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME MITSUI CHEMICALS AGRO, INC. (JP) 2012-11-08 US disclosed
EP-2517562-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASES BY APPLYING THE COMPOSITION Mitsui Chemicals Agro, Inc. (JP) 2012-10-31 EP disclosed
US-8101657-B2 Plant disease and insect damage control composition and plant disease and insect damage prevention method MITSUI CHEMICALS, INC. (JP) 2012-01-24 US disclosed
US-20100071096-A1 PLANT DISEASE AND INSECT DAMAGE CONTROL COMPOSITION AND PLANT DISEASE AND INSECT DAMAGE PREVENTION METHOD MITSUI CHEMICALS, INC. (JP) 2010-03-18 US disclosed
EP-2092826-A1 PEST CONTROL COMPOSITION AND METHOD OF PREVENTING PEST DAMAGE MITSUI CHEMICALS AGRO, INC. (JP) 2009-08-26 EP disclosed
CN-100390047-C Multi-particle and method for producing same YOSHIYUKI KAWAZOE (JP) 2008-05-28 CN disclosed
WO-2006095888-A2 PROCESS FOR PRODUCING A MIXTURE OF PARTICLES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-09-14 WO disclosed
CN-1764597-A Multi-particle and method for producing same KAWAZOE YOSHIYUKI (JP) 2006-04-26 CN 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 (3 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-20240065267-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME SNX1, HAX1, BROX CYP2C19 2075/4885CYP3A4 2379/4885ALDH1A1 3326/4885
US-20120282349-A1 PLANT DISEASE CONTROL COMPOSITION AND METHOD FOR CONTROLLING PLANT DISEASE BY APPLYING THE SAME SNX1, BROX, HAX1 CYP2C19 1680/4885CYP3A4 2297/4885ALDH1A1 3264/4885
US-11805779-B2 Plant disease control composition and method for controlling plant disease by applying the same SNX1, HAX1, BROX CYP2C19 2075/4885CYP3A4 2379/4885ALDH1A1 3326/4885

“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.