SCHEMBL4661824

SCHEMBL4661824

CCOC(=O)c1ccc(N2N=C(C)CC2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.61
KDM4E B2RXH2 5/20 0.61
NPC1 O15118 1/20 0.61
RAB9A P51151 1/20 0.61
GAA P10253 4/20 0.60
ALDH1A1 P00352 5/20 0.56
MEN1 O00255 5/20 0.56
KMT2A Q03164 5/20 0.56
TDP1 Q9NUW8 5/20 0.56
HTT P42858 4/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.55
CHRM2 P08172 1/20 0.55
CYP3A4 P08684 1/20 0.55
CHRM1 P11229 1/20 0.55
TSHR P16473 1/20 0.55
PTGS1 P23219 1/20 0.55
DRD3 P35462 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
RECQL P46063 1/20 0.55

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
SCHEMBL14991191 0.86 APP (0.59) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL29389131 0.84 GAA (0.58) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL19644103 0.84 GAA (0.58) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL31254773 0.83 MAPT (0.55) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL12297639 0.82 ALDH1A1 (0.55) MAPTKDM4ENPC1GAAALDH1A1
SCHEMBL8427633 0.81 ALDH1A1 (0.54) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL643536 0.81 POLB (0.75) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL19659980 0.81 KMT2A (0.64) MAPTKDM4EGAAALDH1A1MEN1
SCHEMBL8425552 0.80 POLB (0.55) MAPTKDM4ENPC1RAB9AGAA
SCHEMBL15691858 0.80 APP (0.53) MAPTKDM4ENPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3684354-B1 XPA INHIBITOR COMPOUNDS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2023-11-15 EP disclosed
US-20220089577-A1 KU INHIBITORS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2022-03-24 US disclosed
EP-3463371-B1 KU INHIBITORS AND THEIR USE UNIV INDIANA RES & TECH CORP (US) 2022-02-23 EP disclosed
US-11207296-B2 XPA inhibitor compounds and their use INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2021-12-28 US disclosed
US-20210128529-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE NOBELPHARMA CO., LTD. (JP) 2021-05-06 US disclosed
CN-112118839-A Pyrazolone derivative-containing drug 耐贝医药株式会社 2020-12-22 CN disclosed
US-20200308154-A1 KU INHIBITORS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-10-01 US disclosed
EP-3684354-A1 XPA INHIBITOR COMPOUNDS AND THEIR USE Indiana University Research and Technology Corporation (US) 2020-07-29 EP disclosed
US-20200222367-A1 XPA INHIBITOR COMPOUNDS AND THEIR USE INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2020-07-16 US disclosed
EP-3666270-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE Nobelpharma Co., Ltd. (JP) 2020-06-17 EP disclosed
EP-1553087-A1 PREVENTIVE AND/OR THERAPEUTIC DRUGS FOR INFLAMMATORY INTESTINAL DISEASES Mitsubishi Pharma Corporation (JP) 2005-07-13 EP disclosed
US-20050009896-A1 Particularly 3-methyl-1-phenyl-2-pyrazolin-5-one; thrombolytic agent, an anticoagulant and/or a platelet aggregation inhibitory agent such as a thromboxane synthetase inhibitor; for treating and/or preventing ischemic diseases which are safe and have few side effects MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-01-13 US disclosed
US-20040254234-A1 Medicament for prevention and/or therapy of arterial wall disorder MITSUBISHI PHARMA CORPORATION (JP) 2004-12-16 US disclosed
EP-1437137-A1 DRUGS COMPRISING COMBINATION OF ANTITHROMBOTIC AGENT WITH PYRAZOLONE DERIVATIVE Mitsubishi Pharma Corporation (JP) 2004-07-14 EP disclosed
US-RE35801-E PYRAZOLONE DERIVATIVES MITSUBISHI CHEMICAL CORPORATION (JP) 1998-05-19 US disclosed
EP-0208874-B1 PROPHYLACTIC AND THERAPEUTIC AGENT FOR CIRCULATORY DISORDERS MITSUBISHI KASEI CORPORATION (JP) 1993-03-24 EP disclosed
US-4857542-A INHIBITOR AGAINST LIPID PEROXIDATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1989-08-15 US disclosed
EP-0208874-A1 Prophylactic and therapeutic agent for circulatory disorders MITSUBISHI KASEI CORPORATION (JP) 1987-01-21 EP disclosed
US-3996282-A Water-soluble quaternary ammonium dyestuffs STERLING DRUG INC. (US) 1976-12-07 US disclosed
US-3935182-A Water-soluble quaternary ammonium heterocyclic azo dyestuffs STERLING DRUG INC. (US) 1976-01-27 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 (7 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-20040254234-A1 Medicament for prevention and/or therapy of arterial wall disorder ADRB3, TNNI3, AGTR1 MAPT 4769/4885KDM4E 3943/4885NPC1 2791/4885
US-20220089577-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX MAPT 3583/4885KDM4E 581/4885NPC1 3278/4885
US-20200222367-A1 XPA INHIBITOR COMPOUNDS AND THEIR USE XPOT, XPA, ERCC4 MAPT 3599/4885KDM4E 1463/4885NPC1 528/4885
US-20050009896-A1 Particularly 3-methyl-1-phenyl-2-pyrazolin-5-one; thrombolytic agent, an anticoagulant and/or a platelet aggregation inhibitory agent such as a thromboxane synthetase inhibitor; for treating and/or preventing ischemic diseases which are safe and have few side effects PLAT, PTGIS, SERPINC1 MAPT 4680/4885KDM4E 3548/4885NPC1 3681/4885
US-11207296-B2 XPA inhibitor compounds and their use XPOT, XPA, ERCC4 MAPT 3599/4885KDM4E 1463/4885NPC1 528/4885
US-20200308154-A1 KU INHIBITORS AND THEIR USE ZFR, XRCC6, ZFX MAPT 3583/4885KDM4E 581/4885NPC1 3278/4885
US-20210128529-A1 DRUG CONTAINING PYRAZOLONE DERIVATIVE CYP11B2, CYP3A5, DPYD MAPT 4271/4885KDM4E 694/4885NPC1 4703/4885

“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.