SCHEMBL5147040

SCHEMBL5147040

CCOC(C)COc1ccccc1/C=C/C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 3/20 0.54
PTGER3 P43115 3/20 0.54
PTGER2 P43116 3/20 0.54
PTGER1 P34995 2/20 0.54
HTT P42858 1/20 0.50
KDM4E B2RXH2 4/20 0.48
GAA P10253 2/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 3/20 0.47
MAPT P10636 3/20 0.47
ATM Q13315 1/20 0.47
NFE2L2 Q16236 2/20 0.43
ALDH1A1 P00352 3/20 0.43
AR P10275 1/20 0.43
PLA2G1B P04054 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
TFEB P19484 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
NFKB1 P19838 1/20 0.42

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
SCHEMBL2961596 0.85 PTGER4 (0.61) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL2961597 0.85 PTGER4 (0.61) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL11683166 0.83 PTGER4 (0.59) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL11683167 0.83 PTGER4 (0.59) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL1536281 0.83 PTGER1 (0.66) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL1536282 0.83 PTGER1 (0.66) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL1356220 0.79 PTGER1 (0.64) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL14843147 0.79 PTGER1 (0.64) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL19252720 0.78 HTT (0.55) PTGER4PTGER3PTGER2PTGER1HTT
SCHEMBL755995 0.78 PTGER3 (0.59) PTGER4PTGER3PTGER2PTGER1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3103436-B1 COMPOUNDS DERIVED FROM 3-(ALKYLTHIO)PROPENOIC ACID, AND THE USE THEREOF IN COSMETICS EXSYMOL SA (MC) 2018-09-12 EP disclosed
US-9815783-B2 (3-alkylthio)propenoic acid-derived compounds and their application in cosmetics EXSYMOL (MC) 2017-11-14 US disclosed
US-20160362364-A1 (3-ALKYLTHIO)PROPENOIC ACID-DERIVED COMPOUNDS AND THEIR APPLICATION IN COSMETICS EXSYMOL (MC) 2016-12-15 US disclosed
EP-3103436-A1 COMPOUNDS DERIVED FROM 3-(ALKYLTHIO)PROPENOIC ACID, AND THE USE THEREOF IN COSMETICS Exsymol (MC) 2016-12-14 EP disclosed
EP-1578386-A4 IMPROVED SUNSCREEN COMPOSITIONS OREAL (FR) 2007-03-14 EP disclosed
EP-1578386-A2 IMPROVED SUNSCREEN COMPOSITIONS L'OREAL (FR) 2005-09-28 EP disclosed
EP-1539064-A2 NOVEL PHOTOSTABILIZERS, UV ABSORBERS, AND METHODS OF PHOTOSTABILIZING A SUNSCREEN COMPOSITION CPH Innovations Corp. (US) 2005-06-15 EP disclosed
WO-2004060276-A2 IMPROVED SUNSCREEN COMPOSITIONS L'OREAL (FR) 2004-07-22 WO disclosed
WO-2004026197-A2 NOVEL PHOTOSTABILIZERS, UV ABSORBERS, AND METHODS OF PHOTOSTABILIZING A SUNSCREEN COMPOSITION CPH INNOVATIONS CORPORATION (US) 2004-04-01 WO disclosed
WO-2004022021-A1 PHOTOSTABILIZATION OF A SUNSCREEN COMPOSITION WITH AN ALPHA-CYANO-ΒΕΤΑ, ΒΕΤΑ-DIPHENYLACRYLATE CPH INNOVATIONS CORPORATION (US) 2004-03-18 WO disclosed
EP-0616522-A1 SUNSCREEN COMPOSITIONS. BOOTS CO PLC (GB) 1994-09-28 EP disclosed
WO-1993011742-A1 SUNSCREEN COMPOSITIONS THE BOOTS COMPANY PLC (GB) 1993-06-24 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 (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-20160362364-A1 (3-ALKYLTHIO)PROPENOIC ACID-DERIVED COMPOUNDS AND THEIR APPLICATION IN COSMETICS ALOX12, ALOX15B, ALOX15 PTGER4 81/4885PTGER3 36/4885PTGER2 61/4885

“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.