SCHEMBL2492020

SCHEMBL2492020

COc1cc(C=CC(=O)O)c(OC(C)=O)c(OC)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.54
PTGS1 P23219 1/20 0.54
PTGS2 P35354 1/20 0.54
KDM4E B2RXH2 6/20 0.50
ALDH1A1 P00352 4/20 0.50
HPGD P15428 2/20 0.50
HSD17B10 Q99714 2/20 0.50
HTR1A P08908 1/20 0.50
HTR2C P28335 1/20 0.50
GAA P10253 3/20 0.48
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
CA6 P23280 2/20 0.43
CA5A P35218 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA5B Q9Y2D0 2/20 0.43

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
SCHEMBL28630448 0.84 PKM (0.61) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL9101731 0.82 PKM (0.55) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL976533 0.81 PKM (0.58) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL16093497 0.79 NFE2L2 (0.62) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL2394283 0.78 PKM (0.54) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL3789794 0.77 KDM4E (0.65) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL3789790 0.77 KDM4E (0.65) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL25380226 0.77 KDM4E (0.60) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL6852555 0.75 NFE2L2 (0.69) PKMPTGS1PTGS2KDM4EALDH1A1
SCHEMBL6852559 0.75 NFE2L2 (0.69) PKMPTGS1PTGS2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580775-B2 Use of derivatives of sinapinic acid and compositions comprising such derivatives COGNIS IP MANAGEMENT GMBH (DE) 2013-11-12 US disclosed
EP-2117499-B1 Use of sinapic acid in non-therapeutic cosmetic and/or topical compositions COGNIS IP MAN GMBH (DE) 2011-10-26 EP disclosed
US-20100130605-A1 Use of Derivatives of Sinapinic Acid and Compositions Comprising Such Derivatives COGNIS IP MANAGEMENT GMBH (DE) 2010-05-27 US disclosed
EP-2117499-A1 USE OF DERIVATIVES OF SINAPINIC ACID AND COMPOSITIONS COMPRISING SUCH DERIVATIVES Cognis IP Management GmbH (DE) 2009-11-18 EP disclosed
WO-2008107093-A1 USE OF DERIVATIVES OF SINAPINIC ACID AND COMPOSITIONS COMPRISING SUCH DERIVATIVES COGNIS IP MANAGEMENT GMBH (DE) 2008-09-12 WO disclosed
EP-1967175-A1 Use of derivatives of sinapinic acid and compositions comprising such derivatives Cognis IP Management GmbH (DE) 2008-09-10 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-20100130605-A1 Use of Derivatives of Sinapinic Acid and Compositions Comprising Such Derivatives TYR, ASAH1, AANAT PKM 1859/4885PTGS1 449/4885PTGS2 895/4885

“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.