SCHEMBL4736677

SCHEMBL4736677

CC(C)(CO)NCCS(=O)(=O)O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.32
PDE4A P27815 1/20 0.32
LMNA P02545 1/20 0.32
SLC6A6 P31641 1/20 0.32
CYP2C19 P33261 1/20 0.32
BLM P54132 1/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 1/20 0.31
DPP4 P27487 1/20 0.30
APP P05067 1/20 0.30
HTT P42858 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
SCHEMBL918122 0.88 APP (0.37) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL918752 0.79 LMNA (0.36) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL24451378 0.79 ALDH1A1 (0.37) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL439388 0.77 PTGS1 (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL4404059 0.77 LMNA (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL35763 0.77 PTGS1 (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL1078938 0.77 PTGS1 (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL12927516 0.76 HTT (0.35) DPP4HTT
SCHEMBL29538945 0.76 CYP2D6 (0.35) PTGS1PDE4ALMNASLC6A6CYP2C19
SCHEMBL23242898 0.76 PTGS1 (0.33) PTGS1PDE4ALMNASLC6A6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170313920-A1 Biological Buffers with Wide Buffering Ranges DALY THOMAS P (US) 2017-11-02 US disclosed
US-20170260435-A1 Biological Buffers with Wide Buffering Ranges DALY THOMAS P (US) 2017-09-14 US disclosed
US-20160369142-A1 Biological Buffers with Wide Buffering Ranges DALY THOMAS P (US) 2016-12-22 US disclosed
US-9475754-B2 Biological buffers with wide buffering ranges TPAT IP LLC 2016-10-25 US disclosed
US-20160280634-A1 Biological Buffers with Wide Buffering Ranges TPAT IP LLC 2016-09-29 US disclosed
US-9447310-B2 Biological buffers with wide buffering ranges TPAT IP LLC 2016-09-20 US disclosed
US-20160194283-A1 Biological Buffers with Wide Buffering Ranges TPAT IP LLC 2016-07-07 US disclosed
US-9090638-B2 Biological buffers with wide buffering ranges TPAT IP LLC 2015-07-28 US disclosed
US-8822728-B2 Biological buffers with wide buffering ranges TPAT IP LLC 2014-09-02 US disclosed
US-20140073789-A1 Biological Buffers with Wide Buffering Ranges TPAT IP LLC 2014-03-13 US disclosed
US-8519141-B2 Biological buffers with wide buffering ranges TPAT IP LLC 2013-08-27 US disclosed
WO-2008070368-A2 METHODS AND COMPOSITIONS FOR SKIN CARE LIVING PROOF, INC. (US) 2008-06-12 WO disclosed
EP-1446090-A2 COMPOSITIONS CONTAINING ENZYMES STABILIZED WITH CERTAIN OSMO-PROTECTANTS AND METHODS FOR USING SUCH COMPOSITIONS IN PERSONAL CARE THE PROCTER & GAMBLE COMPANY (US) 2004-08-18 EP disclosed
EP-1446096-A1 TOPICAL COMPOSITIONS CONTAINING ENZYMES STABILISED WITH INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2004-08-18 EP disclosed
US-20030175232-A1 Compositions containing enzymes stabilized with certain osmo-protectants and methods for using such compositions in personal care THE PROCTER & GAMBLE COMPANY 2003-09-18 US disclosed
US-20030157088-A1 Compositions containing enzymes stabilized with inhibitors having certain binding properties and methods for using such compositions in personal care THE PROCTOR & GAMBLE COMPANY 2003-08-21 US disclosed
WO-2003041667-A2 COMPOSITIONS CONTAINING ENZYMES STABILIZED WITH CERTAIN OSMO-PROTECTANTS AND METHODS FOR USING SUCH COMPOSITIONS IN PERSONAL CARE THE PROCTER & GAMBLE COMPANY (US) 2003-05-22 WO disclosed
WO-2003041680-A1 TOPICAL COMPOSITIONS CONTAINING ENZYMES STABILIZED WITH INHIBITORS THE PROCTER & GAMBLE COMPANY (US) 2003-05-22 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 (8 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-20170260435-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885
US-20140073789-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885
US-20160280634-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885
US-20030175232-A1 Compositions containing enzymes stabilized with certain osmo-protectants and methods for using such compositions in personal care TREH, CUTA, LPO PTGS1 2757/4885PDE4A 1687/4885LMNA 1798/4885
US-20160194283-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885
US-20160369142-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885
US-20030157088-A1 Compositions containing enzymes stabilized with inhibitors having certain binding properties and methods for using such compositions in personal care CUTA, LCT, TYR PTGS1 3207/4885PDE4A 1680/4885LMNA 599/4885
US-20170313920-A1 Biological Buffers with Wide Buffering Ranges PEF1, SLC7A1, PLPBP PTGS1 2181/4885PDE4A 20/4885LMNA 1639/4885

“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.