SCHEMBL968544

SCHEMBL968544

O=C(CCS)OCO.O=C(CCS)OCO.O=C(CCS)OCO

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.35
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAPT P10636 1/20 0.31
BLM P54132 1/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
FOLH1 Q04609 1/20 0.31
DGKA P23743 1/20 0.30
CYP1A2 P05177 1/20 0.30

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
SCHEMBL28138317 1.00
Mercaptopropionic Acid SCHEMBL7063475 0.91 ACE (0.44) ACETSHRFOLH1
SCHEMBL27937955 0.84
SCHEMBL11759205 0.82 ACE (0.38) ACEADRA2AADRA1ATSHRHSD17B10
SCHEMBL1815437 0.82 ADRA2A (0.43) ADRA2AADRA1ATSHRMAPTBLM
SCHEMBL3515575 0.80
SCHEMBL98980 0.80 DGKA (0.46) ACEADRA2AADRA1ATSHRHSD17B10
Ethylene Glycol SCHEMBL2593485 0.79 DGKA (0.41) ACEADRA2AADRA1ATSHRMAPT
SCHEMBL30250320 0.79 MGLL (0.41) ACEADRA2AADRA1ATSHRMAPT
SCHEMBL718982 0.79

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2328964-A2 MULTI-CURE COMPOSITIONS PPG Industries Ohio, Inc. (US) 2011-06-08 EP claimed
US-7871704-B2 Multi-cure compositions comprising polythiol PPG INDUSTRIES OHIO, INC. (US) 2011-01-18 US claimed
WO-2010027756-A2 MULTI-CURE COMPOSITIONS COMPRISING POLYTHIOL PPG INDUSTRIES OHIO, INC. (US) 2010-03-11 WO claimed
US-20100056722-A1 MULTI-CURE COMPOSITIONS COMPRISING POLYTHIOL PPG INDUSTRIES OHIO, INC. (US) 2010-03-04 US claimed
CN-116736632-A Colored photosensitive resin composition, color filter manufactured using the same, and display device including the color filter 东友精细化工有限公司 2023-09-12 CN disclosed
CN-112334802-B Core material, light transmitting body using same, method for manufacturing light transmitting body, and lighting device using light transmitting body AUTO化学工业株式会社 2023-08-11 CN disclosed
CN-107015436-B Colored curable resin composition, color filter, and display device comprising the color filter 住友化学株式会社 2022-03-18 CN disclosed
CN-113980274-A Preparation method of polymer dispersed liquid crystal film 北京大学 2022-01-28 CN disclosed
US-20100272920-A1 Radiation Curable System Garnett, John Lyndon (AU) 2010-10-28 US disclosed
EP-1976934-A4 RADIATION CURABLE SYSTEM GARNETT JOHN LYNDON (AU) 2009-05-13 EP disclosed
EP-1722708-A4 REACTIVE OLIGOMERIC THIOL AND ENE MATERIALS AS DENTAL RESTORATIVE MIXTURES UNIV COLORADO (US) 2009-04-08 EP disclosed
EP-1976934-A1 RADIATION CURABLE SYSTEM Garnett, John Lyndon (AU) 2008-10-08 EP disclosed
US-20070185230-A1 Reactive oligomeric thiol and ene materials as dental restorative mixtures THE REGENTS OF THE UNIVERSITY OF COLORADO CU TECHNOLOGY TRANSFER OFFICE (US) 2007-08-09 US disclosed
WO-2007079541-A1 RADIATION CURABLE SYSTEM GARNETT JOHN LYNDON (AU) 2007-07-19 WO disclosed
EP-1722708-A2 REACTIVE OLIGOMERIC THIOL AND ENE MATERIALS AS DENTAL RESTORATIVE MIXTURES The Regents of the University of Colorado (US) 2006-11-22 EP disclosed
WO-2005086911-A2 REACTIVE OLIGOMERIC THIOL AND ENE MATERIALS AS DENTAL RESTORATIVE MIXTURES THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2005-09-22 WO disclosed
US-4465823-A Ethylenically unsaturated crosslinkable transparent polyamide CIBA-GEIGY CORPORATION (US) 1984-08-14 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 (1 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-20070185230-A1 Reactive oligomeric thiol and ene materials as dental restorative mixtures PSME2, PSME3, TAS2R42 ACE 4739/4885ADRA2A 3070/4885ADRA1A 2993/4885

“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.