SCHEMBL1496045

SCHEMBL1496045

O=C(O)CCOc1ccc(Cl)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.70
RAB9A P51151 2/20 0.69
MAPT P10636 1/20 0.63
TSHR P16473 3/20 0.62
PTGDR2 Q9Y5Y4 2/20 0.59
HPGD P15428 3/20 0.58
NPC1 O15118 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
NLRP1 Q9C000 1/20 0.57
MRGPRX4 Q96LA9 3/20 0.56
FFAR1 O14842 1/20 0.56
TP53 P04637 1/20 0.56
MAPK1 P28482 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CYP1A2 P05177 2/20 0.55
CYP2C19 P33261 2/20 0.55
CYP3A4 P08684 1/20 0.55
GAA P10253 1/20 0.55

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
Ammonia Solution, Strong SCHEMBL8439387 0.98 TDP1 (0.68) TDP1RAB9AMAPTTSHRPTGDR2
Dimethylamine SCHEMBL8441597 0.94 TSHR (0.73) TDP1RAB9AMAPTTSHRPTGDR2
SCHEMBL116448 0.93 RAB9A (0.78) TDP1RAB9AMAPTTSHRPTGDR2
SCHEMBL29364868 0.93 RAB9A (0.78) TDP1RAB9AMAPTTSHRPTGDR2
Hydrochloric Acid SCHEMBL11002766 0.92 RAB9A (0.76) TDP1RAB9AMAPTTSHRPTGDR2
SCHEMBL10381793 0.92 RAB9A (0.72) TDP1RAB9AMAPTTSHRPTGDR2
SCHEMBL10381113 0.90 RAB9A (0.70) TDP1RAB9AMAPTTSHRPTGDR2
SCHEMBL10382178 0.90 RAB9A (0.70) TDP1RAB9AMAPTTSHRPTGDR2
Dimethylamine SCHEMBL5080159 0.87 RAB9A (0.75) TDP1RAB9AMAPTTSHRHPGD
2,4-Dichlorophenoxyacetic Acid SCHEMBL9525998 0.87 TDP1 (0.82) TDP1RAB9AMAPTTSHRPTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115581235-B Weeding composition and application thereof 允发化工(上海)有限公司 2024-05-03 CN claimed
CN-117363589-A P450 enzyme mutant for degrading phenoxy carboxylic acid herbicide and application thereof 山东大学 2024-01-09 CN claimed
CN-109283276-B Gas chromatography for determining residues of eight phenoxy carboxylic acid herbicides in corn 丁立平 2021-05-07 CN claimed
CN-111548264-A Herbicide dimethylamine salt and preparation method thereof 岳晟 2020-08-18 CN claimed
EP-2104422-B1 OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS HUNTSMAN PETROCHEMICAL LLC (US) 2018-09-05 EP claimed
WO-2016029146-A1 SPECIFIC INHIBITORS OF METHIONYL-TRNA SYNTHETASE UNIVERSITY OF WASHINGTON (US) 2016-02-25 WO claimed
US-20090325808-A1 OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2009-12-31 US claimed
EP-2104422-A2 OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS Huntsman Petrochemical Corporation (US) 2009-09-30 EP claimed
WO-2008036864-A2 OSTWALD RIPENING INHIBITION IN CHEMICAL FORMULATIONS HUNTSMAN PETROCHEMICAL CORPORATION (US) 2008-03-27 WO claimed
US-20070149404-A1 Microbicidal compositions BASF AKTIENGESELLSCHAFT (DE) 2007-06-28 US claimed
US-4971630-A LIQUID MIXTURE FOR SPRAYING FROM AIRCRAFT PBI/GORDON CORPORATION (US) 1990-11-20 US claimed
EP-0297305-A1 Liquid pesticidal mixture formulations HOECHST AKTIENGESELLSCHAFT (DE) 1989-01-04 EP claimed
US-4776882-A PENETRATION OF WOODY PLANTS USING PHOSPHATE OR PHTHALATE ESTER CARRIER FOR HERBICIDES RHONE POULENC NEDERLANDS B.V. (NL) 1988-10-11 US claimed
EP-0275556-A2 Herbicidal composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-07-27 EP claimed
EP-0230902-A1 Basal spray compositions and method of applying same RHONE-POULENC NEDERLAND B.V. (NL) 1987-08-05 EP claimed
EP-0116229-A2 Basal spray compositions and method of applying same RHONE-POULENC NEDERLAND B.V. (NL) 1984-08-22 EP claimed
EP-0113857-A1 Herbicidal agents BAYER AG (DE) 1984-07-25 EP claimed
EP-0052825-A1 Selective herbicidal agents on the basis of triazine diones BAYER AG (DE) 1982-06-02 EP claimed
US-4256481-A Selective herbicide compositions NITROKEMIA IPARTELEPEK (HU) 1981-03-17 US claimed
US-4213776-A Herbicidal concentrate containing ketone and amide solvents UNIROYAL LTD. (CA) 1980-07-22 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20070149404-A1 Microbicidal compositions MGLL, CAT, DDT TDP1 670/4885RAB9A 3208/4885MAPT 3525/4885

“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.