SCHEMBL3948948

SCHEMBL3948948

OCCC1CNCCN1Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.54
POLB P06746 3/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 1/20 0.49
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
GAA P10253 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
CA4 P22748 2/20 0.46
CA9 Q16790 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46

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
SCHEMBL6008090 1.00 SIGMAR1 (0.54) SIGMAR1POLBALDH1A1LMNASLC6A2
SCHEMBL23496876 1.00 SIGMAR1 (0.54) SIGMAR1POLBALDH1A1LMNASLC6A2
SCHEMBL1738860 0.88 SIGMAR1 (0.53) SIGMAR1SLC6A2SLC6A4SLC6A3CA1
SCHEMBL8101234 0.88 SIGMAR1 (0.53) SIGMAR1SLC6A2SLC6A4SLC6A3CA1
SCHEMBL2080509 0.88 SIGMAR1 (0.53) SIGMAR1SLC6A2SLC6A4SLC6A3CA1
SCHEMBL22640155 0.86 ALDH1A1 (0.52) SIGMAR1POLBALDH1A1GAAMEN1
SCHEMBL22640117 0.86 ALDH1A1 (0.52) SIGMAR1POLBALDH1A1GAAMEN1
SCHEMBL6323998 0.84 SLC6A2 (0.50) SIGMAR1SLC6A2SLC6A4SLC6A3
SCHEMBL1415727 0.83 SLC6A2 (0.63) SIGMAR1SLC6A2SLC6A4SLC6A3CA1
SCHEMBL6936570 0.83 SLC6A2 (0.63) SIGMAR1SLC6A2SLC6A4SLC6A3CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112384509-B Furin inhibitors 葛兰素史密斯克莱知识产权发展有限公司 2024-04-30 CN disclosed
CN-117659016-A Cyclin modulators 嘉兴优博生物技术有限公司 2024-03-08 CN disclosed
WO-2024041661-A1 CYCLIN MODULATOR 嘉兴优博生物技术有限公司 2024-02-29 WO disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
EP-3790871-B1 FURIN INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2024-01-24 EP disclosed
US-20230339968-A1 KRAS Gl2C INHIBITORS ELI LILLY AND COMPANY 2023-10-26 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-20220315556-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-10-06 US disclosed
US-7442694-B2 Diazabicyclic compounds useful in the treatment of CNS and other disorders PFIZER INC (US) 2008-10-28 US disclosed
US-7365075-B2 Aryl sulfonamide compounds and uses related thereto AMGEN INC. (US) 2008-04-29 US disclosed
US-7365075-B2 Aryl sulfonamide compounds and uses related thereto AMGEN INC. (US) 2008-04-29 US disclosed
US-7365075-B2 Aryl sulfonamide compounds and uses related thereto AMGEN INC. (US) 2008-04-29 US disclosed
EP-1703908-A1 ARYL SULFONAMIDE COMPOUNDS AND USES RELATED THERETO Amgen Inc. (US) 2006-09-27 EP disclosed
US-20050277649-A1 Aryl sulfonamide compounds and uses related thereto AMGEN SF, LLC (US) 2005-12-15 US disclosed
WO-2005063247-A1 ARYL SULFONAMIDE COMPOUNDS AND USES RELATED THERETO AMGEN INC. (US) 2005-07-14 WO disclosed
EP-1551843-A1 DIAZABICYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF CNS AND OTHER DISORDERS Pfizer Products Inc. (US) 2005-07-13 EP disclosed
US-20040106603-A1 Diazabicyclic compounds useful in the treatment of CNS and other disorders PFIZER INC 2004-06-03 US disclosed
WO-2004024729-A1 DIAZABICYCLIC COMPOUNDS USEFUL IN THE TREATMENT OF CNS AND OTHER DISORDERS PFIZER PRODUCTS INC. (US) 2004-03-25 WO 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-20230339968-A1 KRAS Gl2C INHIBITORS KRAS, NRAS, GLS2 SIGMAR1 2828/4885POLB 2065/4885ALDH1A1 1144/4885
US-20220315556-A1 FURIN INHIBITORS FURIN, TGFB1, PCSK7 SIGMAR1 4873/4885POLB 2731/4885ALDH1A1 3733/4885
US-20050277649-A1 Aryl sulfonamide compounds and uses related thereto SULT2A1, ARSA, SULT1A1 SIGMAR1 1669/4885POLB 4650/4885ALDH1A1 118/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 SIGMAR1 4873/4885POLB 2731/4885ALDH1A1 3733/4885
US-20040106603-A1 Diazabicyclic compounds useful in the treatment of CNS and other disorders DBH, CHRNA6, DDT SIGMAR1 532/4885POLB 1431/4885ALDH1A1 126/4885

“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.