SCHEMBL8865229

SCHEMBL8865229

COC(=O)/C=C/c1ccncc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.68
MAPT P10636 2/20 0.68
CA12 O43570 1/20 0.65
CA1 P00915 1/20 0.65
CA2 P00918 1/20 0.65
TYR P14679 1/20 0.65
CA7 P43166 1/20 0.65
CA9 Q16790 1/20 0.65
CA14 Q9ULX7 1/20 0.65
JUN P05412 1/20 0.62
NFKB1 P19838 1/20 0.62
PTPN1 P18031 1/20 0.56
TTR P02766 1/20 0.54
APP P05067 1/20 0.54
CYP1A2 P05177 5/20 0.53
CYP2D6 P10635 4/20 0.53
CYP1A1 P04798 4/20 0.53
CYP1B1 Q16678 4/20 0.53
EPHX2 P34913 1/20 0.50
SMN1; SMN2 Q16637 4/20 0.49

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
SCHEMBL10398774 1.00 KDM4E (0.68) KDM4EMAPTCA12CA1CA2
SCHEMBL4683429 1.00 KDM4E (0.68) KDM4EMAPTCA12CA1CA2
SCHEMBL9250169 0.87 KDM4E (0.55) KDM4EMAPTCA12CA1CA2
SCHEMBL9247583 0.87 KDM4E (0.55) KDM4EMAPTCA12CA1CA2
SCHEMBL71224 0.86 CA12 (0.84) KDM4EMAPTCA12CA1CA2
SCHEMBL5057418 0.86 CA12 (0.84) KDM4EMAPTCA12CA1CA2
SCHEMBL21001858 0.84 JUN (0.67) KDM4EMAPTCA12CA1CA2
SCHEMBL7747441 0.82 KDM4E (0.61) KDM4EMAPTCA12CA1CA2
SCHEMBL7747445 0.82 KDM4E (0.61) KDM4EMAPTCA12CA1CA2
SCHEMBL9104771 0.80 CA12 (0.54) KDM4EMAPTCA12CA1CA2

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
WO-2025101944-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THAT DEGRADE SWI/SNF-RELATED MATRIX-ASSOCIATED ACTIN-DEPENDENT REGULATOR OF CHROMATIN SUBFAMILY A Plexium, Inc. (US) 2025-05-15 WO disclosed
US-20240217932-A1 PYRIDIUM ESTERS THE PROCTER AND GAMBLE COMPANY 2024-07-04 US disclosed
US-11760743-B2 Acyloxy substituted phenyl dithiane derivatives Renovel Innovations, Inc. 2023-09-19 US disclosed
US-20230285372-A1 Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives MEDCURIUS INC. (CN) 2023-09-14 US disclosed
US-20230285372-A1 Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives MEDCURIUS INC. (CN) 2023-09-14 US disclosed
WO-2021259143-A1 PHARMACEUTICAL USE OF (E)-3-ARYLHETEROCYCLYL PROP-2-ENOIC ACID DERIVATIVES 上海长车生物科技有限公司 2021-12-30 WO disclosed
US-20190002454-A1 NRF2 Regulators GLAXOSMITHKLINE IP DEV LTD (GB) 2019-01-03 US disclosed
US-20190002454-A1 NRF2 Regulators GLAXOSMITHKLINE IP DEV LTD (GB) 2019-01-03 US disclosed
US-10144731-B2 Nrf2 regulators GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-12-04 US disclosed
CN-105829305-B NRF2 regulator 葛兰素史密斯克莱知识产权发展有限公司 2018-11-30 CN disclosed
US-5382578-A Anticonvulsants or antiischemic agents G. D. SEARLE & CO. (US) 1995-01-17 US disclosed
US-5380721-A Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1995-01-10 US disclosed
EP-0610303-A1 SUBSTITUTED DIBENZOXAZEPINE COMPOUNDS AS ANALGESIC AGENTS G.D. SEARLE & CO. (US) 1994-08-17 EP disclosed
EP-0597540-A1 Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents STERLING WINTHROP INC. (US) 1994-05-18 EP disclosed
EP-0425211-B1 Substituted 5-((tetrazolyl)alkenyl)-imidazoles SMITHKLINE BEECHAM CORP (US) 1994-03-30 EP disclosed
US-5288719-A 2-,3-,8-and/or 10-substituted dibenzoxazepine compounds, pharmaceutical compositions and methods for treating osteoporosis G. D. SEARLE & CO. (US) 1994-02-22 US disclosed
US-5212169-A Analgesics G. D. SEARLE & CO. (US) 1993-05-18 US disclosed
WO-1993009105-A1 SUBSTITUTED DIBENZOXAZEPINE COMPOUNDS AS ANALGESIC AGENTS G.D. SEARLE & CO. (US) 1993-05-13 WO disclosed
EP-0539977-A1 SUBSTITUTED DIBENZOXAZEPINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE AS ANALGESIC AGENTS AND PROSTAGLANDIN ANTAGONISTS G.D. Searle & Co. (US) 1993-05-05 EP disclosed
EP-0425211-A1 Substituted 5-((tetrazolyl)alkenyl)-imidazoles SMITHKLINE BEECHAM CORPORATION (US) 1991-05-02 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-11760743-B2 Acyloxy substituted phenyl dithiane derivatives AADAC, TBXA2R, DECR2 KDM4E 1877/4885MAPT 3050/4885CA12 964/4885
US-20190002454-A1 NRF2 Regulators NFE2L2, KEAP1, NQO1 KDM4E 1805/4885MAPT 1861/4885CA12 4870/4885
US-20240217932-A1 PYRIDIUM ESTERS C5, CBR3, CHRM1 KDM4E 1739/4885MAPT 4762/4885CA12 3752/4885
US-20230285372-A1 Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives NFE2L2, NFE2, TXNRD2 KDM4E 3813/4885MAPT 3234/4885CA12 4585/4885
US-10144731-B2 Nrf2 regulators NFE2L2, KEAP1, NQO1 KDM4E 1805/4885MAPT 1861/4885CA12 4870/4885

“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.