SCHEMBL3728368

SCHEMBL3728368

O=C(O)CCOc1cccc(Cl)c1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.61
PPARG P37231 4/20 0.58
PPARD Q03181 4/20 0.58
FFAR1 O14842 4/20 0.58
RXRA P19793 1/20 0.55
RXRB P28702 1/20 0.55
RXRG P48443 1/20 0.55
MCL1 Q07820 1/20 0.54
DRD2 P14416 1/20 0.54
DRD4 P21917 1/20 0.54
ALDH1A1 P00352 1/20 0.53
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
LMNA P02545 1/20 0.53
MAPK1 P28482 1/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HRH3 Q9Y5N1 3/20 0.52

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
SCHEMBL30025989 1.00 KDM4E (0.61) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL20591018 0.98 KDM4E (0.60) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL30025954 0.92 KDM4E (0.62) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL2914775 0.92 KDM4E (0.62) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL13348919 0.89 KDM4E (0.59) KDM4EPPARGPPARDFFAR1DRD2
SCHEMBL6849640 0.85 WDR5 (0.57) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL29447016 0.82 LMNA (0.64) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL523934 0.82 LMNA (0.64) KDM4EPPARGPPARDFFAR1RXRA
SCHEMBL11782966 0.82 KDM4E (0.57) KDM4EPPARGPPARDDRD2DRD4
SCHEMBL6846925 0.81 KDM4E (0.58) KDM4EPPARGPPARDFFAR1RXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0539274-B1 Method for the synthesis of aldehydes and of their derivatives RHONE POULENC CHIMIE (FR) 1996-04-10 EP claimed
EP-3704094-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-11 EP disclosed
US-20250122188-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2025-04-17 US disclosed
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-05-23 US disclosed
EP-4356971-A2 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2024-04-24 EP disclosed
CN-117378604-A Pesticide composition for stem and leaf treatment 组合化学工业株式会社 2024-01-12 CN disclosed
CN-115947681-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2023-04-11 CN disclosed
US-20220363678-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-11-17 US disclosed
CN-109641844-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2022-11-01 CN disclosed
CN-108495553-B Synergistic herbicidal composition 江苏龙灯化学有限公司 2021-11-23 CN disclosed
US-20080154049-A1 for acylation of an aromatic compound, comprising reacting an aromatic compound and an acylating agent of the carboxylic acid type, in the presence of a Lewis acid and of a silylated reagent selected from the group consisting of halosilanes and halosiloxanes. SHASUN PHARMA SOLUTIONS LIMITED (GB) 2008-06-26 US disclosed
WO-2008022242-A2 SYNTHESIS OF PROPYL PHENOXY ETHERS AND USE AS DELIVERY AGENTS EMISPHERE TECHNOLOGIES, INC. (US) 2008-02-21 WO disclosed
US-7214804-B2 Heterocyclic compounds useful as growth hormone secretagogues BRISTOL-MYERS SQUIBB COMPANY (US) 2007-05-08 US disclosed
WO-2005070884-A2 HETEROCYCLIC COMPOUNDS USEFUL AS GROWTH HORMONE SECRETAGOGUES BRISTOL-MYERS SQUIBB COMPANY (US) 2005-08-04 WO disclosed
US-20050154043-A1 Heterocyclic compounds useful as growth hormone secretagogues BRISTOL-MYERS SQUIBB COMPANY 2005-07-14 US disclosed
WO-2001045704-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-06-28 WO disclosed
US-6180830-B1 REDUCING COMPLEX OF RUTHENIUM HAVING ELECTROVALENCY OF-4 AND COORDINATION NUMBER OF 6, WHEREIN AT LEAST ONE LIGAND IS TIN HALIDE, OTHER LIGANDS OPTIONALLY BEING HALOGEN ATOMS RHODIA CHIMIE (FR) 2001-01-30 US disclosed
EP-0068041-B1 FLOWABLE HERBICIDE AND PESTICIDE COMPOSITIONS AND THEIR USE J.T. Baker Chemical Co. (US) 1985-08-21 EP disclosed
US-4389238-A Flowable herbicide and pesticide formulation J. T. BAKER CHEMICAL COMPANY (US) 1983-06-21 US disclosed
EP-0068041-A1 Flowable herbicide and pesticide compositions and their use J.T. Baker Chemical Co. (US) 1983-01-05 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 (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-20250122188-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 KDM4E 4646/4885PPARG 724/4885PPARD 1954/4885
US-20050154043-A1 Heterocyclic compounds useful as growth hormone secretagogues GHRHR, GHSR, CRH KDM4E 3169/4885PPARG 716/4885PPARD 1437/4885
US-20240166652-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 KDM4E 4646/4885PPARG 724/4885PPARD 1954/4885
US-20220363678-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 KDM4E 4646/4885PPARG 724/4885PPARD 1954/4885
US-20080154049-A1 for acylation of an aromatic compound, comprising reacting an aromatic compound and an acylating agent of the carboxylic acid type, in the presence of a Lewis acid and of a silylated reagent selected from the group consisting of halosilanes and halosiloxanes. AADAC, APEH, DDC KDM4E 795/4885PPARG 823/4885PPARD 1801/4885

“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.