SCHEMBL743575

SCHEMBL743575

CC(C)(C)N(C(=O)O)[C@@H]1CCNC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.37
SLC6A2 P23975 11/20 0.37
SLC6A3 Q01959 4/20 0.37
KCNH2 Q12809 2/20 0.36
SLC6A1 P30531 2/20 0.36
GABRA5 P31644 2/20 0.36
GABRB2 P47870 2/20 0.36
SLC6A12 P48065 2/20 0.36
SLC6A11 P48066 2/20 0.36
SLC6A13 Q9NSD5 2/20 0.36
GABRA1 P14867 1/20 0.36
GABRR1 P24046 1/20 0.36
GABRA4 P48169 1/20 0.36

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
SCHEMBL476847 1.00 SLC6A4 (0.37) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL1290220 1.00 SLC6A4 (0.37) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL14632099 0.89 SLC6A1 (0.43) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL124776 0.89 SLC6A1 (0.43) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL612826 0.89 SLC6A1 (0.43) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL13719286 0.89 SLC6A1 (0.43) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL1305814 0.89 GABRA5 (0.40) SLC6A4SLC6A2SLC6A3SLC6A1GABRA5
SCHEMBL1564564 0.88 SLC6A1 (0.38) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL16763685 0.88 SLC6A1 (0.38) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1
SCHEMBL16763687 0.88 SLC6A1 (0.38) SLC6A4SLC6A2SLC6A3KCNH2SLC6A1

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
WO-2026106389-A1 NMT INHIBITOR AND USE THEREOF 주식회사 이노보테라퓨틱스 2026-05-21 WO disclosed
US-12325696-B2 Indazole derivative, preparation method therefor, and pharmaceutical application thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2025-06-10 US disclosed
WO-2023109959-A1 CDK9 INHIBITOR AND USE THEREOF 药捷安康(南京)科技股份有限公司 2023-06-22 WO disclosed
CN-110105346-B Optionally substituted quinoline compounds 卫材R&D管理有限公司 2023-03-10 CN disclosed
CN-115557946-A Heterocyclic lactam compound, pharmaceutical composition containing same and application thereof 四川科伦博泰生物医药股份有限公司 2023-01-03 CN disclosed
WO-2022253309-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND APPLICATION THEREOF 首药控股(北京)股份有限公司 2022-12-08 WO disclosed
US-20220267304-A1 INDAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATION THEREOF JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2022-08-25 US disclosed
CN-114401955-A Inhibitors of cyclin dependent kinases 金耐特生物制药公司 2022-04-26 CN disclosed
CN-109071560-B Thienopyridine carboxamides as ubiquitin-specific protease inhibitors 瓦洛健康公司 2022-01-14 CN disclosed
EP-3190116-B1 PYRAZOLOTHIAZOLE COMPOUND AND MEDICINE COMPRISING SAME NIPPON SHINYAKU CO LTD (JP) 2020-08-05 EP disclosed
US-7795256-B2 Thieno-pyridinone derivatives as kinase inhibitors UCB PHARMA S.A. (BE) 2010-09-14 US disclosed
US-20100173901-A1 Substituted Heterocyclic Compounds INCYTE CORPORATION (US) 2010-07-08 US disclosed
US-20100069630-A1 NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-03-18 US disclosed
US-7655652-B2 2-{4-[4-(2-hydroxyacetyl)piperazin-1-yl]anilino}-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)-5-fluoropyrimidine hydrochloride; cell cycle inhibitory; rheumatoid arthritis ASTRAZENECA AB (SE) 2010-02-02 US disclosed
US-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity PALAU PHARMA, S.A. (ES) 2009-12-10 US disclosed
US-20070161615-A1 Chemical compounds ASTRAZENECA AB (SE) 2007-07-12 US disclosed
US-20070078131-A1 Thieno-pyridinone derivatives as kinase inhibitors CELLTECH R&D LIMITED (GB) 2007-04-05 US disclosed
US-7141596-B2 Inhibitors of proteins that bind phosphorylated molecules INCYTE CORPORATION (US) 2006-11-28 US disclosed
US-20060173018-A1 Quinazolines useful as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED 2006-08-03 US disclosed
US-20050272778-A1 Inhibitors of proteins that bind phosphorylated molecules INCYTE CORPORATION 2005-12-08 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 (9 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-20100173901-A1 Substituted Heterocyclic Compounds HRH4, HRH2, HRH1 SLC6A4 1012/4885SLC6A2 1020/4885SLC6A3 2506/4885
US-20100069630-A1 NAPHTHALENYLOXYPROPENYL DERIVATIVES HAVING INHIBITORY ACTIVITY AGAINST HISTONE DEACETYLASE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME HDAC1, HDAC3, HDAC11 SLC6A4 4254/4885SLC6A2 4559/4885SLC6A3 4493/4885
US-20070161615-A1 Chemical compounds MKI67, PCNA, CCNI SLC6A4 3268/4885SLC6A2 3165/4885SLC6A3 4044/4885
US-12325696-B2 Indazole derivative, preparation method therefor, and pharmaceutical application thereof CYP19A1, HSD17B11, CYP51A1 SLC6A4 2979/4885SLC6A2 4150/4885SLC6A3 3496/4885
US-20050272778-A1 Inhibitors of proteins that bind phosphorylated molecules PPP3CA, PPP5C, PPM1A SLC6A4 4520/4885SLC6A2 4688/4885SLC6A3 4453/4885
US-20060173018-A1 Quinazolines useful as modulators of ion channels KCNQ1, KCNQ2, KCNN3 SLC6A4 198/4885SLC6A2 179/4885SLC6A3 193/4885
US-20220267304-A1 INDAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL APPLICATION THEREOF CYP19A1, HSD17B11, CYP51A1 SLC6A4 2979/4885SLC6A2 4150/4885SLC6A3 3496/4885
US-20070078131-A1 Thieno-pyridinone derivatives as kinase inhibitors MAP3K6, MAP4K2, MAP3K15 SLC6A4 3390/4885SLC6A2 3381/4885SLC6A3 3717/4885
US-20090306038-A1 2-Aminopyrimidine derivatives as modulators of the histamine H4 receptor activity HRH4, HRH2, HRH3 SLC6A4 476/4885SLC6A2 558/4885SLC6A3 2186/4885

“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.