SCHEMBL901093

SCHEMBL901093

C=C(C)C(O)C(=O)OCC

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.46
LMNA P02545 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
TSHR P16473 3/20 0.39
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
SOAT1 P35610 1/20 0.39
THRB P10828 1/20 0.38
TRPA1 O75762 1/20 0.36
GLO1 Q04760 1/20 0.35
CYP2C9 P11712 1/20 0.34
CASP1 P29466 1/20 0.34
PIN1 Q13526 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
SCHEMBL9574819 0.82 ALDH1A1 (0.42) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL1249258 0.82 ALDH1A1 (0.53) ALDH1A1LMNAHSD17B10TSHRALOX15
SCHEMBL28436056 0.80 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL903306 0.80 ALDH1A1 (0.50) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL16449969 0.79 CYP2D6 (0.45) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL11867292 0.79 SOAT1 (0.42) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL10763074 0.77 CASP1 (0.46) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL7922346 0.77 TSHR (0.57) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL11058541 0.76 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19
SCHEMBL11324188 0.76 ALDH1A1 (0.46) ALDH1A1LMNAHSD17B10CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1597658-A Preparation method of 3-methyl-2-[5-(2-chloro-4-trifluoro methyl phonoxy) -2- nitrobenzoxy]-3-ethyl isocrotonate SHENYANG CHEMICAL INDUSTRY INS (CN) 2005-03-23 CN claimed
US-12331027-B2 Herbicidal pyridylethers BASF SE 2025-06-17 US disclosed
CN-111356684-B Herbicidal pyridyl ethers 巴斯夫欧洲公司 2025-03-28 CN disclosed
CN-112745269-B Phenyl isoxazoline compound and application thereof 沈阳中化农药化工研发有限公司 2023-01-24 CN disclosed
CN-112745269-A Phenyl isoxazoline compound and application thereof 沈阳中化农药化工研发有限公司 2021-05-04 CN disclosed
US-20200392103-A1 HERBICIDAL PYRIDYLETHERS BASF SE (DE) 2020-12-17 US disclosed
CN-111356684-A Herbicidal pyridyl ethers 巴斯夫欧洲公司 2020-06-30 CN disclosed
WO-2019101513-A1 HERBICIDAL PYRIDYLETHERS BASF SE (DE) 2019-05-31 WO disclosed
CN-105102417-A Method for producing 4-halosenecioic acid derivative SAGAMI CHEMICAL RES INST 2015-11-25 CN disclosed
CN-104557546-A Method for synthesizing 2-hydroxy-3-methyl-3-ethyl crotonate YANCHENG CITY CHUNZHU AROMA CO LTD 2015-04-29 CN disclosed
CN-1059718-A The weedicide that contains the  oxazolidinedione derivatives SAGAMI CHEM RES (JP) 1992-03-25 CN disclosed
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
EP-0413832-A1 OXAZOLIDINEDIONE DERIVATIVES AND PRODUCTION THEREOF SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-02-27 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
EP-0382884-A1 Oxazolidinedione compounds, the process for preparing the same and herbicidal composition containing the same SAGAMI CHEMICAL RESEARCH CENTER (JP) 1990-08-22 EP disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed
CN-86108416-A Oxazolidinedione derivative, process for producing the same, and herbicide containing the same 1987-07-29 CN disclosed
US-4621150-A METAL PERHALATE OR SULFONATE OR COMPLEX; GLYCIDATE, 2-HYDROXY-3-BUTENOATE, EPOXIDE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1986-11-04 US disclosed
EP-0153692-A2 Method for isomerization a glycidate derivative SAGAMI CHEMICAL RESEARCH CENTER (JP) 1985-09-04 EP 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-20200392103-A1 HERBICIDAL PYRIDYLETHERS DDT, PLPBP, PNPO ALDH1A1 37/4885LMNA 3155/4885HSD17B10 654/4885
US-12331027-B2 Herbicidal pyridylethers DDT, PLPBP, PNPO ALDH1A1 37/4885LMNA 3155/4885HSD17B10 654/4885

“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.