SCHEMBL1107140

SCHEMBL1107140

CCOC(=O)Cc1ccccc1C

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.55
CYP4F2 P78329 2/20 0.53
CYP4A11 Q02928 2/20 0.53
CTBP2 P56545 1/20 0.50
NLRP3 Q96P20 2/20 0.49
ALDH1A1 P00352 2/20 0.48
GAA P10253 1/20 0.48
SHBG P04278 1/20 0.47
TSHR P16473 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TBXAS1 P24557 1/20 0.46
L3MBTL1 Q9Y468 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
SCHEMBL30249949 1.00 PKM (0.55) PKMCYP4F2CYP4A11CTBP2NLRP3
SCHEMBL9417685 0.93 NLRP3 (0.55) PKMCYP4F2CYP4A11CTBP2NLRP3
Hydrochloric Acid SCHEMBL27700462 0.92 NLRP3 (0.54) PKMCYP4F2CYP4A11CTBP2NLRP3
Diethylamine SCHEMBL27877467 0.92 PKM (0.49) PKMCYP4F2CYP4A11CTBP2NLRP3
Isopropyl Alcohol SCHEMBL28139339 0.90 PKM (0.48) PKMCYP4F2CYP4A11CTBP2NLRP3
SCHEMBL68340 0.90 PKM (0.60) PKMCYP4F2CYP4A11NLRP3ALDH1A1
SCHEMBL2400235 0.87 CTBP2 (0.50) PKMCYP4F2CYP4A11CTBP2ALDH1A1
SCHEMBL6878047 0.86 PKM (0.57) PKMCYP4F2CYP4A11NLRP3ALDH1A1
SCHEMBL31424953 0.86 PKM (0.57) PKMCYP4F2CYP4A11NLRP3ALDH1A1
SCHEMBL31424955 0.86 PKM (0.57) PKMCYP4F2CYP4A11NLRP3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113308705-A Electrooxidation preparation method of kresoxim-methyl and trifloxystrobin intermediate 湖南大学 2021-08-27 CN claimed
CN-112745216-A Preparation method of methyl 4-bromomethylbenzoate and derivatives thereof 常州锐博生物科技有限公司 2021-05-04 CN claimed
CN-109928868-A The synthetic method and its application of bis- (2,5- 3,5-dimethylphenyl) the propyl- 2- ketone of 1,3- 河北科技大学 2019-06-25 CN claimed
CN-108752510-A Without iron catalysis AGET ATRP systems and polymerization under the conditions of ligand in a kind of biomass-based solvent 安徽工程大学 2018-11-06 CN claimed
CN-105985241-A Inhibition effect of [alpha]-substituted phenyl acetate compounds on [alpha]-glycosidase and application of the compounds 邵阳学院 2016-10-05 CN claimed
CN-105523874-A Preparation method of 2,2-dihalo-1,3-dicarbonyl derivatives ZHANGJIAGANG INST IND TECHNOLOGIES SOOCHOW UNIV 2016-04-27 CN claimed
CN-105503635-A Preparation method for 2-amidoformyl-1,3-dicarbonyl derivative UNIV SOOCHOW 2016-04-20 CN claimed
CN-105461496-A Preparation method for 2-halogenated-1,3-dicarbonyl derivative CHINASUN SPECIALTY PRODUCTS CO LTD 2016-04-06 CN claimed
US-12435181-B2 Formulations capable of reacting with or removal of molecular oxygen LI SHENSHEN (US) 2025-10-07 US disclosed
US-20250287942-A1 FORMULATIONS FOR REPELLING BEES AND OTHER INSECTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-09-18 US disclosed
EP-4510829-A2 FORMULATIONS FOR REPELLING BEES AND OTHER INSECTS The Regents of University of California (US) 2025-02-26 EP disclosed
CN-116135892-B Method for preparing bimodal polyethylene resin for pipe material and bimodal polyethylene resin thereof 中国石油化工股份有限公司 2024-10-15 CN disclosed
US-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-07-18 US disclosed
CN-118324632-A Method for synthesizing ester compound from carbonic ester and carboxylic acid 中国科学院山西煤炭化学研究所 2024-07-12 CN disclosed
WO-1985000596-A1 PROCESS FOR THE PRODUCTION OF CARBOXYLIC ACID ESTERS THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1985-02-14 WO disclosed
EP-0132144-A1 Process for the production of carboxylic acid esters The British Petroleum Company p.l.c. (GB) 1985-01-23 EP disclosed
EP-0042250-B1 MACROLIDE ANTIOBIOTICS ELI LILLY AND COMPANY (US) 1984-03-07 EP disclosed
US-4301278-A BY HYDROGENATION IN THE PRESENCE OF A CATALYST CIBA-GEIGY CORPORATION (US) 1981-11-17 US disclosed
US-4283548-A Diisatoic acid or triisatoic acid derivatives LIM-HOLDING S.A (LU) 1981-08-11 US disclosed
US-3940486-A Imidazole derivatives in the treatment of pain CIBA-GEIGY CORPORATION (US) 1976-02-24 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-20240239752-A1 BICYCLIC HETEROAROMATIC INHIBITORS OF KLK5 KLK5, KLK1, KLKB1 PKM 487/4885CYP4F2 631/4885CYP4A11 229/4885
US-20250287942-A1 FORMULATIONS FOR REPELLING BEES AND OTHER INSECTS ACHE, BCHE, DDT PKM 4405/4885CYP4F2 789/4885CYP4A11 1351/4885

“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.