SCHEMBL1791123

SCHEMBL1791123

NC(=O)c1ccc(-c2ccc(O)cc2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP10 Q53GL7 2/20 0.65
▸ HSD17B1 P14061 1/20 0.60
▸ FYN P06241 1/20 0.59
▸ CA12 O43570 1/20 0.57
▸ CA1 P00915 1/20 0.57
▸ CA2 P00918 1/20 0.57
▸ CA9 Q16790 1/20 0.57
▸ CA14 Q9ULX7 1/20 0.57
▸ LMNA P02545 3/20 0.56
▸ MAPT P10636 3/20 0.56
▸ KMT2A Q03164 2/20 0.56
▸ MEN1 O00255 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ ESR1 P03372 3/20 0.55
▸ ESR2 Q92731 3/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ PDPK1 O15530 1/20 0.54
▸ MKNK1 Q9BUB5 3/20 0.53
▸ MKNK2 Q9HBH9 3/20 0.53
▸ ERN1 O75460 1/20 0.53

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
Hydroquinone SCHEMBL8674228 0.92 PARP10 (0.74) PARP10FYNCA12CA1CA2
SCHEMBL28823636 0.92 PARP10 (0.74) PARP10FYNCA12CA1CA2
SCHEMBL162830 0.92 PARP10 (0.74) PARP10FYNCA12CA1CA2
Methane SCHEMBL28048015 0.90 PARP10 (0.71) PARP10FYNCA12CA1CA2
Ammonia Solution, Strong SCHEMBL28805645 0.90 PARP10 (0.71) PARP10FYNCA12CA1CA2
SCHEMBL28831945 0.90 PARP10 (0.71) PARP10FYNCA12CA1CA2
Hydrochloric Acid SCHEMBL3139339 0.90 PARP10 (0.71) PARP10FYNCA12CA1CA2
SCHEMBL1002578 0.89 CA2 (0.67) PARP10CA12CA1CA2CA9
SCHEMBL25338154 0.85 PARP10 (0.65) PARP10FYNCA12CA1CA2
SCHEMBL4300988 0.83 PARP10 (0.63) PARP10FYNCA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8208578-A — — None — — JP disclosed
JP-8208586-A — — None — — JP disclosed
US-20240287175-A1 COMPOSITIONS AND METHODS FOR TREATING AGE-RELATED DISEASES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2024-08-29 — — US disclosed
US-11891442-B2 Compositions and methods for treating age-related diseases THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2024-02-06 — — US disclosed
US-20230174668-A1 COMPOSITIONS AND METHODS FOR TREATING LYSOSOMAL STORAGE DISORDERS THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2023-06-08 — — US disclosed
US-20220315926-A1 An Aptamer for Dengue Virus and Related Methods and Products AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2022-10-06 — — US disclosed
WO-2022149617-A1 COMPOUND LIBRARY 中外製薬株式会社 2022-07-14 — — WO disclosed
WO-2021236577-A1 COMPOSITIONS AND METHODS FOR TREATING LYSOSOMAL STORAGE DISORDERS THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2021-11-25 — — WO disclosed
US-20200317778-A1 COMPOSITIONS AND METHODS FOR TREATING AGE-RELATED DISEASES THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2020-10-08 — — US disclosed
EP-2739608-B1 INSULIN SECRETION PROMOTING AGENTS VAL-CHUM LTD PARTNERSHIP (CA) 2017-09-06 — — EP disclosed
US-20110124559-A1 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS SMITHKLINE BEECHAM CORPORATION (US) 2011-05-26 — — US disclosed
US-20100113512-A1 METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS IGNAR DIANE MICHELE 2010-05-06 — — US disclosed
US-20100113512-A1 METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS IGNAR DIANE MICHELE 2010-05-06 — — US disclosed
US-20100113512-A1 METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS IGNAR DIANE MICHELE 2010-05-06 — — US disclosed
WO-2010025235-A1 SELECTIVE LIGANDS FOR THE DOPAMINE 3 (D3) RECEPTOR AND METHODS OF USING THE SAME REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2010-03-04 — — WO disclosed
EP-2054383-A2 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS SmithKline Beecham Corporation (US) 2009-05-06 — — EP disclosed
WO-2008021849-A2 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO disclosed
WO-2008021849-A2 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS SMITHKLINE BEECHAM CORPORATION (US) 2008-02-21 — — WO disclosed
JP-H08208578-A 4'-CARBAMOYLBIPHENYL COMPOUND AND ITS PRODUCTION SANKO CHEM CO LTD 1996-08-13 — — JP disclosed
JP-H08208586-A PRODUCTION OF 4'-CYANOBIPHENYL-4-OL SANKO CHEM CO LTD 1996-08-13 — — JP 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-20110124559-A1 NOVEL COMPOUNDS AS ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS OPRL1, OPRM1, OPRK1 PARP10 3417/4885HSD17B1 2970/4885FYN 2651/4885
US-20100113512-A1 METHOD OF TREATMENT USING NOVEL ANTAGONISTS OR INVERSE AGONISTS AT OPIOID RECEPTORS OPRL1, OPRD1, OPRK1 PARP10 4470/4885HSD17B1 1414/4885FYN 4593/4885

“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.

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