SCHEMBL5756547

SCHEMBL5756547

O=C(O)C1c2ccccc2Sc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 3/20 0.51
GRM5 P41594 2/20 0.48
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
BCHE P06276 6/20 0.41
EDNRA P25101 2/20 0.41
ACHE P22303 3/20 0.40
NOX1 Q9Y5S8 1/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP2D6 P10635 1/20 0.38
CD69 Q07108 1/20 0.37
EDNRB P24530 1/20 0.37

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
SCHEMBL751446 0.98 GRM1 (0.50) GRM1GRM5ALDH1A1GAABCHE
SCHEMBL6324783 0.87 ALDH1A1 (0.42) GRM1GRM5ALDH1A1GAAEDNRA
SCHEMBL8813838 0.85 BCHE (0.46) GRM1GRM5BCHEACHENOX1
SCHEMBL27503672 0.84 GRM1 (0.45) GRM1GRM5ALDH1A1GAABCHE
SCHEMBL8814780 0.84 GRM1 (0.43) GRM1GRM5ALDH1A1GAABCHE
SCHEMBL11823616 0.83 GRM1 (0.45) GRM1GRM5ALDH1A1GAABCHE
SCHEMBL6970747 0.83 GRM1 (0.42) GRM1GRM5ALDH1A1GAABCHE
SCHEMBL8817077 0.82 GRM1 (0.40) GRM1GRM5ALDH1A1GAANOX1
SCHEMBL10355854 0.81 EDNRA (0.50) ALDH1A1EDNRAMEN1LMNAKMT2A
SCHEMBL11527593 0.81 EDNRA (0.50) ALDH1A1EDNRAMEN1LMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1303499-B1 TETRAZOLE DERIVATIVES HOFFMANN LA ROCHE (CH) 2006-07-12 EP claimed
EP-1303499-A1 TETRAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-04-23 EP claimed
US-6399641-B1 FOR THERAPY AND PROPHYLAXIS OF PSYCHOSIS, SCHIZOPHRENIA, ALZHEIMER'S DISEASE, COGNITIVE DISORDERS AND RESTRICTED BRAIN FUNCTION CAUSED BY BYPASS OPERATIONS OR TRANSPLANTS, POOR BLOOD SUPPLY TO THE BRAIN, SPINAL CORD INJURIES ETC. HOFFMANN-LA ROCHE INC. 2002-06-04 US claimed
US-20020022648-A1 Novel 2H-tetrazole-amide compounds with therapeutic activity as metabotropic glutamate receptor agonists HOFFMANN-LA ROCHE INC. 2002-02-21 US claimed
WO-2002006254-A1 TETRAZOLE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-01-24 WO claimed
EP-3947351-B1 SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF UNIV TEXAS (US) 2026-03-11 EP disclosed
US-12491188-B2 Small molecule PARG inhibitors and methods of use thereof BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2025-12-09 US disclosed
US-20220202821-A1 SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-06-30 US disclosed
EP-3947351-A2 SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF Board of Regents, The University of Texas System (US) 2022-02-09 EP disclosed
WO-2020205646-A2 SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-10-08 WO disclosed
US-10683275-B2 Leveler, leveler composition and method for electrodeposition of metals in microelectronics Shinhao Materials LLC (CN) 2020-06-16 US disclosed
US-20190263773-A1 LEVELER, LEVELER COMPOSITION AND METHOD FOR ELECTRODEPOSITION OF METALS IN MICROELECTRONICS Shinhao Materials LLC (CN) 2019-08-29 US disclosed
US-5922558-A REACTING A PEROXIDASE ENZYME WITH A PEROXIDE AND AT LEAST ONE NOVEL COMPOUND HAVING AN ELECTRON RICH C-C DOUBLE BOND REACTIVE TO PEROXIDASE AND THE PEROXIDE TO PRODUCE AN EXCITED STATE COMPOUND; ALSO USEFUL IN ASSAYS FOR PEROXIDASE ENZYMES LUMIGEN, INC. (US) 1999-07-13 US disclosed
EP-0916668-A1 CHEMOKINE RECEPTOR ANTAGONISTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-05-19 EP disclosed
WO-1999014358-A1 CHEMILUMINESCENCE COMPOSITIONS AND METHODS LUMIGEN, INC. (US) 1999-03-25 WO disclosed
WO-1999014220-A1 NOVEL COMPOUNDS FOR GENERATING CHEMILUMINESCENCE WITH A PEROXIDASE LUMIGEN, INC. (US) 1999-03-25 WO disclosed
WO-1997006178-A1 PYRIMIDINE NUCLEOSIDES F. HOFFMANN-LA ROCHE AG (CH) 1997-02-20 WO disclosed
US-5258260-A Aqueous developable deep UV negative resist OLIN CORPORATION (US) 1993-11-02 US disclosed
US-5258265-A Aqueous developable deep UV negative resist OLIN CORPORATION (US) 1993-11-02 US disclosed
US-5178987-A Aqueous developable deep UV negative resist containing benzannelated acetic acid and novolak resin OLIN CORPORATION (US) 1993-01-12 US 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-10683275-B2 Leveler, leveler composition and method for electrodeposition of metals in microelectronics KCNN4, MB, KCNN2 GRM1 942/4885GRM5 1131/4885ALDH1A1 563/4885
US-12491188-B2 Small molecule PARG inhibitors and methods of use thereof PARG, PARP15, PLG GRM1 3972/4885GRM5 1047/4885ALDH1A1 4146/4885
US-20220202821-A1 SMALL MOLECULE PARG INHIBITORS AND METHODS OF USE THEREOF PARG, PARP15, PLG GRM1 3972/4885GRM5 1047/4885ALDH1A1 4146/4885
US-20190263773-A1 LEVELER, LEVELER COMPOSITION AND METHOD FOR ELECTRODEPOSITION OF METALS IN MICROELECTRONICS KCNN4, MB, KCNN2 GRM1 942/4885GRM5 1131/4885ALDH1A1 563/4885
US-20020022648-A1 Novel 2H-tetrazole-amide compounds with therapeutic activity as metabotropic glutamate receptor agonists GRM1, GRM3, GRM2 GRM1 1/4885GRM5 4/4885ALDH1A1 2423/4885

“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.