SCHEMBL441891

SCHEMBL441891

COC(C)OC.N#CCCC=O

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
TSHR P16473 2/20 0.32

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
SCHEMBL10434417 0.88 TSHR (0.35) TSHR
SCHEMBL11771455 0.86 TSHR (0.39) TSHR
SCHEMBL10955194 0.80 TSHR (0.33) TSHR
SCHEMBL7811459 0.80 LMNA (0.46) ALDH1A1TSHR
SCHEMBL449954 0.79
Ethylene SCHEMBL10487157 0.77 LMNA (0.43) ALDH1A1TSHR
SCHEMBL27479420 0.77
SCHEMBL11438122 0.76 ALDH1A1 (0.31) ALDH1A1
Butanal SCHEMBL6247082 0.73 ALDH1A1 (0.60) ALDH1A1TSHR
SCHEMBL713319 0.71 ALDH1A1 (0.32) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9112094-B2 Copper tin sulfide and copper zinc tin sulfide ink compositions E I DU PONT DE NEMOURS AND COMPANY (US) 2015-08-18 US disclosed
US-9105796-B2 CZTS/Se precursor inks and methods for preparing CZTS/Se thin films and CZTS/Se-based photovoltaic cells E I DU PONT DE NEMOURS AND COMPANY (US) 2015-08-11 US disclosed
US-20150118144-A1 DISPERSIBLE METAL CHALCOGENIDE NANOPARTICLES E I DU PONT NEMOURS AND COMPANY (US) 2015-04-30 US disclosed
US-20140144500-A1 SEMICONDUCTOR INKS FILMS, COATED SUBSTRATES AND METHODS OF PREPARATION E I DU PONT DE NEMOURS AND COMPANY (US) 2014-05-29 US disclosed
WO-2013172949-A1 DISPERSIBLE METAL CHALCOGENIDE NANOPARTICLES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2013-11-21 WO disclosed
US-20130264526-A1 MOLECULAR PRECURSORS AND PROCESSES FOR PREPARING COPPER INDIUM GALLIUM SULFIDE/SELENIDE COATINGS AND FILMS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-10-10 US disclosed
US-20130233202-A1 INKS AND PROCESSES FOR PREPARING COPPER INDIUM GALLIUM SULFIDE/SELENIDE COATINGS AND FILMS EI DU PONT DE NEMOURS AND COMPANY (US) 2013-09-12 US disclosed
US-20130125988-A1 CZTS/Se PRECURSOR INKS AND METHODS FOR PREPARING CZTS/Se THIN FILMS AND CZTS/Se-BASED PHOTOVOLTAIC CELLS E I DU PONT DE NEMOURS AND COMPANY (US) 2013-05-23 US disclosed
WO-2012075267-A1 INKS AND PROCESSES FOR PREPARING COPPER INDIUM GALLIUM SULFIDE/SELENIDE COATINGS AND FILMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-07 WO disclosed
WO-2012075259-A1 MOLECULAR PRECURSORS AND PROCESSES FOR PREPARING COPPER INDIUM GALLIUM SULFIDE/SELENIDE COATINGS AND FILMS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2012-06-07 WO disclosed
US-6552188-B2 Inhibit cell adhesion and cell infiltration; useful treating asthma, allergies, rheumatic diseases, arteriosclerosis, and inflammation; 2-(3,4,5-trimethoxyphenyl),4-((4-substituted piperazin-1-yl)methyl)pyridine compounds KOWA CO., LTD. (JP) 2003-04-22 US disclosed
US-20030060461-A1 Cyclic diamine compound with condensed-ring groups KOWA CO., LTD. (JP) 2003-03-27 US disclosed
US-20030022887-A1 Unsymmetrical cyclic diamine compound KOWA CO., LTD. (JP) 2003-01-30 US disclosed
EP-0256128-B1 INDOLEACETIC ACID DERIVATIVES AND USE THEREOF AS PLANT GROWTH REGULATORS NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1991-11-06 EP disclosed
US-4894387-A RELIEF FROM PAIN FROM VASODILATION GLAXO GROUP LIMITED (GB) 1990-01-16 US disclosed
EP-0147107-B1 INDOLE DERIVATES GLAXO GROUP LIMITED (GB) 1989-08-02 EP disclosed
US-4816470-A Heterocyclic compounds GLAXO GROUP LIMITED 1989-03-28 US disclosed
US-4806143-A Indoleacetic acid derivatives and application thereof as plant growth regulators NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1989-02-21 US disclosed
EP-0147107-A1 Indole derivates GLAXO GROUP LIMITED (GB) 1985-07-03 EP disclosed
EP-0145459-A2 Process for the production of chemical compounds GLAXO GROUP LIMITED (GB) 1985-06-19 EP 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 (2 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-20030022887-A1 Unsymmetrical cyclic diamine compound H1-0, DDAH1, AOC1 ALDH1A1 1083/4885TSHR 2816/4885
US-20030060461-A1 Cyclic diamine compound with condensed-ring groups HRH4, HRH3, HRH1 ALDH1A1 468/4885TSHR 1963/4885

“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.