SCHEMBL4945135

SCHEMBL4945135

COC1=C(OC)C(=O)OC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.39
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
KDM4E B2RXH2 3/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
CYP19A1 P11511 3/20 0.34
ALDH1A1 P00352 2/20 0.33
CYP1A2 P05177 2/20 0.33
MAPT P10636 2/20 0.33
CYP2C9 P11712 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGS1 P23219 1/20 0.33
NUAK1 O60285 1/20 0.32
IGF1R P08069 1/20 0.32
MET P08581 1/20 0.32
PIM1 P11309 1/20 0.32
SRC P12931 1/20 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
SCHEMBL3197752 0.76
SCHEMBL16446607 0.73
SCHEMBL15127518 0.73
SCHEMBL9192106 0.69 KMT2A (0.58) CYP19A1ALDH1A1MAPTKMT2APTGS1
SCHEMBL9197663 0.65 PTGS1 (0.47) LMNACYP19A1MAPTKMT2APTGS1
SCHEMBL9192631 0.65 PTGS1 (0.47) CYP19A1MAPTKMT2APTGS1
SCHEMBL9191512 0.64 PTGS1 (0.42) CYP3A4KDM4ELMNASMN1; SMN2GAA
SCHEMBL18029596 0.63
SCHEMBL7164796 0.62 KDM4E (0.34) CYP3A4KDM4ELMNASMN1; SMN2GAA
SCHEMBL4574015 0.61 NUAK1 (0.31) CYP3A4NUAK1IGF1RMETPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230248037-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2023-08-10 US claimed
EP-3459358-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-12-02 EP claimed
EP-3461343-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-12-02 EP claimed
EP-3461347-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-08-12 EP claimed
EP-3461347-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-04-03 EP claimed
EP-3461343-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-04-03 EP claimed
EP-3459358-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-03-27 EP claimed
EP-2914133-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-28 EP claimed
EP-2914131-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-28 EP claimed
EP-2914132-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-21 EP claimed
US-20150282506-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-10-08 US claimed
US-20150257412-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-09-17 US claimed
US-20150250210-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-09-10 US claimed
EP-2914131-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP claimed
EP-2914132-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP claimed
EP-2914133-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP claimed
WO-2014068045-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO claimed
WO-2014068044-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO claimed
WO-2014068043-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO claimed
US-20230248037-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2023-08-10 US disclosed
CN-109757611-B Application and method of amino acid and furanone, pet food and preparation method of pet food 马斯公司 2023-01-31 CN disclosed
EP-3459358-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-12-02 EP disclosed
EP-3461343-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-12-02 EP disclosed
EP-3461347-B1 FLAVOUR ADDITIVES MARS INC (US) 2020-08-12 EP disclosed
EP-3461347-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-04-03 EP disclosed
EP-3461343-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-04-03 EP disclosed
EP-3459358-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2019-03-27 EP disclosed
EP-2914131-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-28 EP disclosed
EP-2914133-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-28 EP disclosed
EP-2914132-B1 FLAVOUR ADDITIVES MARS INC (US) 2018-11-21 EP disclosed
US-20150282506-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-10-08 US disclosed
US-20150257412-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-09-17 US disclosed
US-20150250210-A1 FLAVOUR ADDITIVES MARS, INCORPORATED 2015-09-10 US disclosed
EP-2914133-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP disclosed
EP-2914131-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP disclosed
EP-2914132-A1 FLAVOUR ADDITIVES Mars, Incorporated (US) 2015-09-09 EP disclosed
WO-2014068044-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO disclosed
WO-2014068043-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO disclosed
WO-2014068045-A1 FLAVOUR ADDITIVES MARS, INCORPORATED (US) 2014-05-08 WO disclosed
US-20080242585-A1 Disubstituted Tetrathianes as Fragrances or Flavourings SYMRISE GMBH & CO. KG (DE) 2008-10-02 US disclosed
CN-101014586-A Disubstituted tetrathianes as fragrances or flavourings SYMRISE GMBH & CO KG (DE) 2007-08-08 CN disclosed
EP-1069116-B1 N-(2-Mercaptoethyl)-1,3-thiazolidines and their use as fragrances and flavourings HAARMANN & REIMER GMBH (DE) 2003-06-04 EP disclosed
EP-1069117-B1 4-Alkanoyl-3-thiazolines and their use as fragrances and flavourings HAARMANN & REIMER GMBH (DE) 2003-01-15 EP disclosed
US-6392054-B1 ORGANOLEPTIC HAARMANN & REIMER GMBH (DE) 2002-05-21 US disclosed
US-6313306-B1 AROMATIZING AGENTS HAARMANN & REIMER GMBH (DE) 2001-11-06 US disclosed
EP-1069116-A1 N-(2-Mercaptoethyl)-1,3-thiazolidines and their use as fragrances and flavourings HAARMANN & REIMER GMBH (DE) 2001-01-17 EP disclosed
EP-1069116-A1 N-(2-Mercaptoethyl)-1,3-thiazolidines and their use as fragrances and flavourings HAARMANN & REIMER GMBH (DE) 2001-01-17 EP disclosed
EP-1069117-A1 4-Alkanoyl-3-thiazolines and their use as fragrances and flavourings HAARMANN & REIMER GMBH (DE) 2001-01-17 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 (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-20080242585-A1 Disubstituted Tetrathianes as Fragrances or Flavourings TAS2R1, TAS1R3, TAS2R3 CYP3A4 395/4885CA1 3302/4885CA9 3023/4885

“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.