SCHEMBL3860141

SCHEMBL3860141

NNC(=S)Nc1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 1.00
MAPT P10636 1/20 1.00
IDO1 P14902 9/20 0.64
NOX1 Q9Y5S8 1/20 0.60
ALDH1A1 P00352 2/20 0.58
GAA P10253 1/20 0.58
EPHX1 P07099 1/20 0.56
CNR1 P21554 1/20 0.56
NPC1 O15118 1/20 0.53
RAB9A P51151 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
SCHEMBL455344 0.89 IDO1 (0.78) KDM4EMAPTIDO1ALDH1A1GAA
SCHEMBL16904097 0.86 MAPT (0.74) KDM4EMAPTIDO1ALDH1A1GAA
SCHEMBL5445907 0.86 MAPT (0.75) KDM4EMAPTNOX1ALDH1A1GAA
SCHEMBL8956455 0.86 MAPT (0.75) KDM4EMAPTNOX1ALDH1A1GAA
Thiourea SCHEMBL1991944 0.84 MAPT (0.73) KDM4EMAPTNOX1ALDH1A1GAA
SCHEMBL6811504 0.81 RAB9A (0.68) KDM4EMAPTNOX1ALDH1A1GAA
SCHEMBL1642748 0.80 IDO1 (0.67) KDM4EMAPTIDO1ALDH1A1GAA
SCHEMBL455323 0.80 GAA (0.74) KDM4EMAPTIDO1ALDH1A1GAA
SCHEMBL9036606 0.78 IDO1 (1.00) KDM4EMAPTIDO1ALDH1A1EPHX1
SCHEMBL455548 0.78 IDO1 (1.00) KDM4EMAPTIDO1NOX1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016111658-A1 SYNTHESIS OF THIOSEMICARBAZONE DERIVATIVES COMPRISING SULPHONAMIDE GROUP WITH POTENTIAL ANTICONVULSANT ACTIVITY IYIDOGAN AYSEGUL (TR) 2016-07-14 WO claimed
CN-102786464-B Phthiobuzonum derivative and its production and use BEIJING UNION PHARMACEUTICAL FACTORY (CN) 2016-05-11 CN claimed
CN-102786464-A Ftibamzone derivative and preparation method and application thereof BEIJING UNION PHARMACEUTICAL FACTORY 2012-11-21 CN claimed
CN-1990470-B Phthiobuzonum derivative, its manufacturing process, pharmaceutical combination and uses thereof BEIJING XIEHE PHARMACEUTICAL FACTORY 2011-04-20 CN claimed
CN-122010896-A Bicyclol derivative, pharmaceutical composition thereof, preparation method and application thereof 中国医学科学院药物研究所 2026-05-12 CN disclosed
CN-114634502-B 3-Aryl substituted thiazolidine-4-ketone-2-methylene hydrazono methylene-1H-indole derivative and preparation method thereof 复旦大学 2024-05-24 CN disclosed
CN-116874496-A Tricyclic compound and preparation method, pharmaceutical composition and application thereof 东南大学 2023-10-13 CN disclosed
CN-114634502-A 3-aryl substituted thiazolidine-4-ketone-2-ylidenehydrazonomethylene-1H-indole derivatives and preparation method thereof 复旦大学 2022-06-17 CN disclosed
WO-2022086079-A1 DERIVATIVE OF SEMICARBAZONE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND USE THEREOF 고려대학교 산학협력단 2022-04-28 WO disclosed
US-11123350-B2 Metal delivery agents and therapeutic uses of the same THE UNIVERSITY OF MELBOURNE (AU) 2021-09-21 US disclosed
US-20190298734-A1 Metal Delivery Agents and Therapeutic Uses of the Same THE UNIVERSITY OF MELBOURNE (AU) 2019-10-03 US disclosed
CN-106699655-B N- methyl Lomefloxacin aldehyde contracting 4- arylamino thiourea derivatives and its preparation method and application 郑州工业应用技术学院 2019-09-24 CN disclosed
CN-1990470-A Phthiobuzonum derivative, its manufacturing process, pharmaceutical combination and uses thereof BEIJING XIEHE PHARMACEUTICAL F (CN) 2007-07-04 CN disclosed
US-20070093483-A1 Use of derivatives of 2, 4-dihydro-[1,2,4] triazole-3-thione as inhibitors of the enzyme myeloperoxidase (mpo) ASTRAZENECA AB (SE) 2007-04-26 US disclosed
CN-1780822-A Use of derivatives of 2, 4-dihydro- 1,2,4 triazole-3-thione as inhibitors of the enzyme myeloperoxidase (MPO) ASTRAZENECA AB (SE) 2006-05-31 CN disclosed
EP-1620410-A1 USE OF DERIVATIVES OF 2, 4-DIHYDRO- 1,2,4 TRIAZOLE-3-THIONE AS INHIBITORS OF THE ENZYME MYELOPEROXIDASE (MPO) AstraZeneca AB (SE) 2006-02-01 EP disclosed
WO-2004096781-A1 USE OF DERIVATIVES OF 2, 4-DIHYDRO-[1,2,4]TRIAZOLE-3-THIONE AS INHIBITORS O FTEH ENZYME MYELOPEROXIDASE (MPO) ASTRAZENECA AB (SE) 2004-11-11 WO disclosed
US-4871737-A 3-Amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants muscle relaxants and anxiolytics A. H. ROBINS COMPANY, INCORPORATED (US) 1989-10-03 US disclosed
EP-0315433-A2 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A.H. ROBINS COMPANY, INCORPORATED (US) 1989-05-10 EP disclosed
US-4826866-A 3-amino-5-methyl-1H-pyrazole-4-carboxylic acids and esters thereof as anticonvulsants, muscle relaxants and anxiolytics A. H. ROBINS COMPANY, INCORPORATED (US) 1989-05-02 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 (3 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-11123350-B2 Metal delivery agents and therapeutic uses of the same SOD1, SLC30A6, SLC30A5 KDM4E 4230/4885MAPT 53/4885IDO1 2857/4885
US-20190298734-A1 Metal Delivery Agents and Therapeutic Uses of the Same SOD1, SLC30A6, SLC30A5 KDM4E 4230/4885MAPT 53/4885IDO1 2857/4885
US-20070093483-A1 Use of derivatives of 2, 4-dihydro-[1,2,4] triazole-3-thione as inhibitors of the enzyme myeloperoxidase (mpo) MPO, XDH, EPX KDM4E 2540/4885MAPT 2326/4885IDO1 338/4885

“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.