SCHEMBL130491

SCHEMBL130491

O=C(O)c1cc(-n2cccc2)ccc1O

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.74
ALDH1A1 P00352 3/20 0.74
HPGD P15428 3/20 0.74
HSD17B10 Q99714 2/20 0.74
POLB P06746 1/20 0.74
MAPK1 P28482 1/20 0.74
PKM P14618 1/20 0.57
CA1 P00915 3/20 0.52
CA2 P00918 3/20 0.52
PTGS2 P35354 2/20 0.52
CA12 O43570 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA14 Q9ULX7 2/20 0.52
ALOX5 P09917 1/20 0.52
HNF4A P41235 4/20 0.50
ACMSD Q8TDX5 3/20 0.50
DHFR P00374 1/20 0.50
MCL1 Q07820 1/20 0.50
MYC P01106 1/20 0.50

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
SCHEMBL15714465 0.85 ALDH1A1 (1.00) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL1786657 0.80 POLB (0.62) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL1785215 0.80 ALDH1A1 (0.62) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL7824616 0.80 CA12 (0.57) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL7827503 0.77 KDM4E (0.50) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL3140547 0.76 ALDH1A1 (0.67) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL5323825 0.76 ALDH1A1 (0.57) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL3905064 0.76 CA12 (0.60) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL31516833 0.76 POLB (0.60) KDM4EALDH1A1HPGDHSD17B10POLB
SCHEMBL9688748 0.75 HSD17B10 (0.64) KDM4EALDH1A1HPGDHSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027445-A Transition metal organic compound co-doped conductive material and preparation method thereof 陕西科技大学 2024-05-14 CN claimed
WO-2011040680-A2 DYE-SENSITIZED/LIGAND-TO-METAL CHARGE-TRANSFER HYBRID SOLAR CELL COMPRISING A WORKING ELECTRODE INCLUDING NANO-OXIDE LAYER COMPOSED OF NANO-OXIDE PARTICLES ADSORBED WITH DYES AND LIGANDS AND METHOD OF MANUFACTURING THE SAME KOREA INSTITUTE OF ENERGY RESEARCH (KR) 2011-04-07 WO claimed
CN-118027445-A Transition metal organic compound co-doped conductive material and preparation method thereof 陕西科技大学 2024-05-14 CN disclosed
US-20220220368-A1 METHOD FOR PREPARING PHOTORESPONSIVE SELF-POWERED ELECTROCHROMIC PRECURSOR, METHOD FOR FABRICATING PHOTORESPONSIVE SELF-POWERED ELECTROCHROMIC DEVICE AND PHOTORESPONSIVE SELF-POWERED ELECTROCHROMIC DEVICE FABRICATED BY THE FABRICATION METHOD KOREA INSTITUTE OF ENERGY RESEARCH (KR) 2022-07-14 US disclosed
US-10711027-B2 DNA polymerase beta inhibitors THE JOHNS HOPKINS UNIVERSITY (US) 2020-07-14 US disclosed
US-20190202853-A1 DNA POLYMERASE BETA INHIBITORS THE JOHNS HOPKINS UNIVERSITY 2019-07-04 US disclosed
US-8263657-B2 Blocking neurokinins; using a benzene compound containing hydroxy or acetoxy group; antiinflammatory agents INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-09-11 US disclosed
CN-101849953-B Inflammatory cytokine release inhibitor INST MED MOLECULAR DESIGN INC 2012-04-25 CN disclosed
EP-1844766-B1 Inhibitors against the production and release of inflammatory cytokines INST MED MOLECULAR DESIGN INC (JP) 2012-04-18 EP disclosed
EP-1352650-B1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES INST MED MOLECULAR DESIGN INC (JP) 2012-03-07 EP disclosed
US-8097759-B2 Inflammatory cytokine release inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2012-01-17 US disclosed
EP-1352650-A1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES Institute of Medicinal Molecular Design, Inc. (JP) 2003-10-15 EP disclosed
US-20020127577-A1 Bioactive sensors GRAFFINITY PHARMACEUTICALS AG (DE) 2002-09-12 US disclosed
EP-1185869-A2 LIGAND-ANCHOR CONJUGATES FOR PRODUCING A BIOSENSOR LAYER Graffinity Pharmaceutical Design GmbH (DE) 2002-03-13 EP disclosed
WO-2000073796-A2 LIGAND-ANCHOR CONJUGATES FOR PRODUCING A BIOSENSOR LAYER GRAFFINITY PHARMACEUTICAL DESIGN GMBH (DE) 2000-12-07 WO disclosed
US-4654331-A Oral absorption enhancement of carboxylic acid pharmaceuticals using (5-alkyl-2-oxo-1,3-dioxolen-4-yl)methyl ester group MERCK & CO., INC. (US) 1987-03-31 US disclosed
US-4479947-A Oral absorption enhancement of carboxylic acid pharmaceuticals using (5-alkyl-2-oxo-1,3-dioxolen-4-yl)methyl ester group MERCK & CO., INC. (US) 1984-10-30 US disclosed
US-4391814-A Derivatives of antiphlogistically effective carboxylic acids, their preparation and medicinal use SCHERING AKTIENGESELLSCHAFT (DE) 1983-07-05 US disclosed
EP-0070013-A1 Oral absorption enhancement of carboxylic acid pharmaceuticals using (5-alkyl-2-oxo-1,3-dioxolen-4-yl)methyl ester group MERCK & CO. INC. (US) 1983-01-19 EP disclosed
EP-0054812-A1 Derivatives of antiphlogistically active carboxylic acids, their preparation and medical application SCHERING AKTIENGESELLSCHAFT (DE) 1982-06-30 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-10711027-B2 DNA polymerase beta inhibitors POLB, POLH, POLN KDM4E 3702/4885ALDH1A1 908/4885HPGD 506/4885
US-20190202853-A1 DNA POLYMERASE BETA INHIBITORS POLB, POLH, POLN KDM4E 3702/4885ALDH1A1 908/4885HPGD 506/4885

“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.