SCHEMBL4079505

SCHEMBL4079505

NC(CF)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 5/20 0.50
DPP4 P27487 2/20 0.50
F2 P00734 1/20 0.50
HTR2A P28223 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
GBA1 P04062 1/20 0.42

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
SCHEMBL16681069 1.00 SCN4A (0.50) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL1455742 1.00 SCN4A (0.50) SCN4ADPP4F2HTR2ATAAR1
Hydrochloric Acid SCHEMBL25180795 0.97 SCN4A (0.48) SCN4ADPP4F2HTR2ATAAR1
Iodide SCHEMBL28728556 0.97 SCN4A (0.48) SCN4ADPP4F2HTR2ATAAR1
Hydrochloric Acid SCHEMBL25180796 0.97 SCN4A (0.48) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL6642727 0.80 SCN4A (0.52) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL6859189 0.78 DPP4 (0.55) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL2781359 0.78 DPP4 (0.55) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL16367913 0.78 DPP4 (0.55) SCN4ADPP4F2HTR2ATAAR1
SCHEMBL2521653 0.78 DPP4 (0.55) SCN4ADPP4F2HTR2ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026101030-A1 CHIRAL METAL OXIDE-BASED WATER ELECTROLYSIS ELECTRODE, METHOD FOR MANUFACTURING SAME, AND WATER ELECTROLYSIS DEVICE COMPRISING SAME 한양대학교 산학협력단 2026-05-15 WO disclosed
CN-117715481-A Efficient stable two-dimensional perovskite solar cell based on self-addition interval cation directional regulation and control 安徽大学 2024-03-15 CN disclosed
CN-112020357-B Salt of indazolyl-containing tricyclic derivative and crystal form thereof 上海翰森生物医药科技有限公司 2023-08-29 CN disclosed
US-20230150981-A1 N-HETEROARYLALKYL-2-(HETEROCYCLYL AND HETEROCYCLYLMETHYL) ACETAMIDE DERIVATIVES AS SSTR4 AGONISTS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-05-18 US disclosed
CN-115380030-A N-heteroarylalkyl-2- (heterocyclyl and heterocyclylmethyl) acetamide derivatives as SSTR4 agonists 武田药品工业株式会社 2022-11-22 CN disclosed
CN-110546150-B Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof 江苏豪森药业集团有限公司 2021-12-21 CN disclosed
EP-3380471-B1 TETRAHYDRO-8H-PYRIDO[1,2-A]PYRAZINE-8-ONES AS COMT INHIBITORS FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS LIEBER INST INC DBA LIEBER INST FOR BRAIN DEVELOPMENT (US) 2021-09-08 EP disclosed
US-20210139479-A1 COMT Inhibiting Methods and Compositions LIEBER INST INC (US) 2021-05-13 US disclosed
US-10934283-B2 COMT inhibiting methods and compositions LIEBER INSTITUTE, INC. (US) 2021-03-02 US disclosed
CN-112020357-A Salts of indazolyl-containing tricyclic derivatives and crystal forms thereof 上海翰森生物医药科技有限公司 2020-12-01 CN disclosed
US-20090170131-A1 Agents for Imaging Apoptosis BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2009-07-02 US disclosed
CN-101384655-A Fluorinated rylenetetracarboxylic acid derivatives and use thereof BASF SE (DE) 2009-03-11 CN disclosed
CN-101384591-A Antiviral compounds ABBOTT LAB (US) 2009-03-11 CN disclosed
CN-100395234-C Novel CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2008-06-18 CN disclosed
WO-2007134127-A2 AGENTS FOR IMAGING APOPTOSIS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-11-22 WO disclosed
CN-101012193-A Novel CB 1 receptour inverse agonists HOFFMANN LA ROCHE (CH) 2007-08-08 CN disclosed
CN-1305852-C Diaryl ethers as opioid receptor antagonists LILLY CO ELI (US) 2007-03-21 CN disclosed
CN-1829694-A quinoline derivatives and their use in therapy ASTRAZENECA AB (SE) 2006-09-06 CN disclosed
CN-1735593-A Novel CB1 receptor inverse agonists HOFFMANN LA ROCHE (CH) 2006-02-15 CN disclosed
CN-1592624-A Substituted-triazolopyrimidines as anticancer agents WYETH CORP (US) 2005-03-09 CN 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-20210139479-A1 COMT Inhibiting Methods and Compositions COMT, PNMT, HNMT SCN4A 3834/4885DPP4 1119/4885F2 4302/4885
US-10934283-B2 COMT inhibiting methods and compositions COMT, MAOB, MAOA SCN4A 2385/4885DPP4 1190/4885F2 3435/4885
US-20230150981-A1 N-HETEROARYLALKYL-2-(HETEROCYCLYL AND HETEROCYCLYLMETHYL) ACETAMIDE DERIVATIVES AS SSTR4 AGONISTS SSTR4, SSTR3, SSTR5 SCN4A 230/4885DPP4 561/4885F2 2870/4885

“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.