SCHEMBL4610385

SCHEMBL4610385

O=C(O)/C=C/c1ccc(O)c(F)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.70
HSD17B10 Q99714 3/20 0.70
CA12 O43570 3/20 0.70
CA1 P00915 3/20 0.70
CA2 P00918 3/20 0.70
CA3 P07451 3/20 0.70
CA4 P22748 3/20 0.70
CA6 P23280 3/20 0.70
CA5A P35218 3/20 0.70
CA7 P43166 3/20 0.70
CA9 Q16790 3/20 0.70
CA14 Q9ULX7 3/20 0.70
CA5B Q9Y2D0 3/20 0.70
AKR1B10 O60218 3/20 0.70
AKR1B1 P15121 3/20 0.70
DPP4 P27487 2/20 0.70
ALDH1A1 P00352 2/20 0.70
HPGD P15428 2/20 0.70
MAPK1 P28482 2/20 0.70
HDAC3 O15379 2/20 0.70

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
SCHEMBL4610390 1.00 KDM4E (0.70) KDM4EHSD17B10CA12CA1CA2
SCHEMBL407484 0.85 KDM4E (0.58) KDM4EHSD17B10CA12CA1CA2
SCHEMBL407485 0.85 KDM4E (0.58) KDM4EHSD17B10CA12CA1CA2
SCHEMBL29389045 0.85 KDM4E (0.58) KDM4EHSD17B10CA12CA1CA2
SCHEMBL21986697 0.84 IAPP (0.71) KDM4EHSD17B10CA12CA1CA2
SCHEMBL21986702 0.84 IAPP (0.71) KDM4EHSD17B10CA12CA1CA2
SCHEMBL17691544 0.84 BACE1 (0.62) KDM4EHSD17B10CA12CA1CA2
Hydrochloric Acid SCHEMBL27954236 0.83 KDM4E (0.56) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL21114743 0.82 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2
Caffeic Acid SCHEMBL3682144 0.82 KDM4E (1.00) KDM4EHSD17B10CA12CA1CA2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240229088-A1 POLYAMINE ANALOG PRODUCING YEASTS TECHNICAL UNIVERSITY OF DENMARK (DK) 2024-07-11 US disclosed
CN-116574054-A Selective estrogen receptor down regulator compound, preparation method and application 南京中医药大学 2023-08-11 CN disclosed
EP-4051800-A1 POLYAMINE ANALOG PRODUCING YEASTS Chrysea Limited (IE) 2022-09-07 EP disclosed
CN-114585727-A Yeast for producing polyamine analogs 克里希有限公司 2022-06-03 CN disclosed
WO-2021083869-A1 POLYAMINE ANALOG PRODUCING YEASTS CHRYSEA LIMITED (IE) 2021-05-06 WO disclosed
EP-3122751-B1 CONDENSED [1,4]DIAZEPINE COMPOUNDS AS AUTOTAXIN (ATX) AND LYSOPHOSPHATIDIC ACID (LPA) PRODUCTION INHIBITORS HOFFMANN LA ROCHE (CH) 2019-10-30 EP disclosed
EP-2528897-B9 DI-SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMA CO LTD (JP) 2015-04-22 EP disclosed
EP-2528897-B1 DI-SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMA CO LTD (JP) 2014-10-15 EP disclosed
US-8722663-B2 Di-substituted pyridine derivatives as anticancers OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-05-13 US disclosed
EP-2528897-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS Otsuka Pharmaceutical Co., Ltd. (JP) 2012-12-05 EP disclosed
US-20120283242-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-11-08 US disclosed
EP-1781297-B1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-10-15 EP disclosed
EP-1893617-A1 TRICYCLIC COMPOUNDS USEFUL AS SEROTONIN INHIBITORS AND 5-HT1A AGONISTS AND ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2008-03-05 EP disclosed
EP-1781297-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-05-09 EP disclosed
WO-2006138549-A1 TRICYCLIC COMPOUNDS USEFUL AS SEROTONIN INHIBITORS AND 5-HT1A AGONISTS AND ANTAGONISTS WYETH (US) 2006-12-28 WO disclosed
WO-2006018326-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-02-23 WO 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 (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-20120283242-A1 DI - SUBSTITUTED PYRIDINE DERIVATIVES AS ANTICANCERS TPD52L2, CCNE2, CDK2 KDM4E 719/4885HSD17B10 1944/4885CA12 4010/4885

“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.