SCHEMBL828599

SCHEMBL828599

CCCCC(CC)OC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 2/20 0.61
PRKCD Q05655 2/20 0.61
MAPT P10636 1/20 0.49
TP53 P04637 1/20 0.46
TSHR P16473 1/20 0.46
PLA2G4B P0C869 2/20 0.45
RARB P10826 6/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL6429949 0.95 PRKCA (0.56) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL828598 0.94 PRKCA (0.68) PRKCAPRKCDMAPTTSHRALDH1A1
SCHEMBL718186 0.91 PRKCA (0.50) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL4944754 0.90 PRKCA (0.59) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL5373207 0.89 TP53 (0.53) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL16227359 0.89 TP53 (0.53) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL6673106 0.89 TP53 (0.51) PRKCAPRKCDMAPTTP53TSHR
SCHEMBL18489570 0.89 PRKCA (0.62) PRKCAPRKCDTP53TSHRALDH1A1
SCHEMBL9721791 0.89 PRKCA (0.61) PRKCAPRKCDMAPTTSHRALDH1A1
Acrylic Acid SCHEMBL8210114 0.88 PRKCA (0.49) PRKCAPRKCDMAPTTP53TSHR

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510012-A1 PROCESSES FOR THE HYDROGENATION OF PHTHALATE ESTERS ExxonMobil Chemical Patents Inc. (US) 2019-07-17 EP disclosed
US-20190185404-A1 PROCESSES FOR THE HYDROGENATION OF PHTHALATE ESTERS EXXONMOBIL CHEMICAL PATENTS INC. 2019-06-20 US disclosed
US-10017448-B2 Process for hydrogenation of benzenepolycarboxylic acids and derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-07-10 US disclosed
WO-2018046306-A1 PROCESSES FOR THE HYDROGENATION OF PHTHALATE ESTERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-03-15 WO disclosed
US-20170291867-A1 Improved Process for Hydrogenation of Benzenepolycarboxylic Acids and Derivatives Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2017-10-12 US disclosed
EP-3212605-A1 IMPROVED PROCESS FOR HYDROGENATION OF BENZENEPOLYCARBOXYLIC ACIDS AND DERIVITIVES THEREOF ExxonMobil Chemical Patents Inc. (US) 2017-09-06 EP disclosed
WO-2016066410-A1 IMPROVED PROCESS FOR HYDROGENATION OF BENZENEPOLYCARBOXYLIC ACIDS AND DERIVITIVES THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-05-06 WO disclosed
EP-1567470-B1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2013-06-05 EP disclosed
US-8203017-B2 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-06-19 US disclosed
US-8143438-B2 Hydrogenation processes EXXONMOBIL CHEMICAL PATENTS INC. (US) 2012-03-27 US disclosed
US-7893295-B2 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXON MOBIL CHEMICAL PATENTS INC. (US) 2011-02-22 US disclosed
US-7875742-B2 hydrogenating organic compounds by contacting with hydrogen-containing gas in presence of catalyst which comprises catalytically active metals applied to porous catalyst support; catalytically active metals having been derived via decomposed amine complex of metal on support EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-01-25 US disclosed
US-20100184895-A1 Hydrogenation Processes EXXONMOBOIL RESEARCH AND ENGINEERING COMPANY 2010-07-22 US disclosed
US-7732634-B2 hydrogenating organic compounds by contacting with hydrogen-containing gas in presence of catalyst which comprises catalytically active metals applied to porous catalyst support; catalytically active metals having been derived via decomposed amine complex of metal on support EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-06-08 US disclosed
US-7595420-B2 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-09-29 US disclosed
US-20090234152-A1 Hydrogenation of Benzene Polycarboxylic Acids or Derivatives Thereof EXXONMOBIL CHEMICAL PATENTS INC. 2009-09-17 US disclosed
US-20060247461-A1 Hydrogenation of benzene polycarboxylic acids or derivatives thereof EXXONMOBIL CHEMICAL PATENTS INC. 2006-11-02 US disclosed
US-20060149097-A1 Hydrogenation processes EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2006-07-06 US disclosed
EP-1567470-A1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF ExxonMobil Chemical Patents Inc. (US) 2005-08-31 EP disclosed
WO-2004046078-A1 HYDROGENATION OF BENZENE POLYCARBOXYLIC ACIDS OR DERIVATIVES THEREOF EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-06-03 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 (2 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-20060149097-A1 Hydrogenation processes HAO2, HVCN1, AOC3 PRKCA 4298/4885PRKCD 4077/4885MAPT 3739/4885
US-20100184895-A1 Hydrogenation Processes HAO2, HVCN1, AOC3 PRKCA 4298/4885PRKCD 4077/4885MAPT 3739/4885

“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.