SCHEMBL235534

SCHEMBL235534

CCC=CCCc1cccc(C(=O)O)c1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HMGB1 P09429 1/20 0.62
KDM4E B2RXH2 2/20 0.45
HSD17B10 Q99714 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.45
BID P55957 3/20 0.43
BCL2L1 Q07817 3/20 0.43
MCL1 Q07820 3/20 0.43
BAK1 Q16611 3/20 0.43
F7 P08709 3/20 0.43
F3 P13726 3/20 0.43
MMP2 P08253 3/20 0.43
MAPT P10636 1/20 0.43
ALOX15 P16050 1/20 0.43
ECE1 P42892 1/20 0.43
SGMS1 Q86VZ5 1/20 0.43
SGMS2 Q8NHU3 1/20 0.43
MUS81 Q96NY9 1/20 0.43
SAE1 Q9UBE0 1/20 0.43
ALB P02768 1/20 0.41

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
SCHEMBL16240898 1.00 HMGB1 (0.62) HMGB1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL8395993 1.00 HMGB1 (0.62) HMGB1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL31354821 1.00 HMGB1 (0.62) HMGB1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL5056707 0.91 ALDH1A1 (0.52) HMGB1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL2817104 0.86 FOLH1 (0.54) HMGB1KDM4EHSD17B10ALDH1A1BID
SCHEMBL2817110 0.86 FOLH1 (0.54) HMGB1KDM4EHSD17B10ALDH1A1BID
SCHEMBL23748665 0.85 HMGB1 (0.43) HMGB1KDM4EHSD17B10ALDH1A1HPGD
SCHEMBL30853556 0.85 HMGB1 (0.46) HMGB1KDM4EHSD17B10ALDH1A1BID
SCHEMBL7950463 0.84 G6PD (0.47) HMGB1KDM4EHSD17B10ALDH1A1BID
SCHEMBL18604012 0.84 G6PD (0.47) HMGB1KDM4EHSD17B10ALDH1A1BID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10434485-B2 Compositions comprising encapsulated actives within droplets and other compartments THE PROCTER & GAMBLE COMPANY (US) 2019-10-08 US claimed
US-9878299-B2 Methods for encapsulation of actives within droplets and other compartments THE PROCTER & GAMBLE COMPANY (US) 2018-01-30 US claimed
US-20170296996-A1 Compositions Comprising Encapsulated Actives within Droplets and other Compartments PROCTER & GAMBLE (US) 2017-10-19 US claimed
EP-3223801-A1 METHODS FOR ENCAPSULATION OF ACTIVES WITHIN DROPLETS AND OTHER COMPARTMENTS The Procter & Gamble Company (US) 2017-10-04 EP claimed
EP-3223800-A1 COMPOSITIONS COMPRISING ENCAPSULATED ACTIVES WITHIN DROPLETS AND OTHER COMPARTMENTS The Procter & Gamble Company (US) 2017-10-04 EP claimed
US-9718044-B2 Compositions comprising encapsulated actives within droplets and other compartments THE PROCTER & GAMBLE COMPANY (US) 2017-08-01 US claimed
WO-2016085740-A1 COMPOSITIONS COMPRISING ENCAPSULATED ACTIVES WITHIN DROPLETS AND OTHER COMPARTMENTS THE PROCTER & GAMBLE COMPANY (US) 2016-06-02 WO claimed
WO-2016085742-A1 METHODS FOR ENCAPSULATION OF ACTIVES WITHIN DROPLETS AND OTHER COMPARTMENTS THE PROCTER & GAMBLE COMPANY (US) 2016-06-02 WO claimed
US-20160144330-A1 Methods for Encapsulation of Actives within Droplets and other Compartments THE PROCTER & GAMBLE COMPANY 2016-05-26 US claimed
US-20160145535-A1 Compositions Comprising Encapsulated Actives within Droplets and other Compartments THE PROCTER & GAMBLE COMPANY 2016-05-26 US claimed
US-12590264-B2 Profragrance conjugates INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2026-03-31 US disclosed
EP-4433483-B1 FRAGRANCE SUBSTANCES AND FORMULATION CONTAINING THEM INT FLAVORS & FRAGRANCES INC (US) 2026-01-14 EP disclosed
EP-4659819-A2 A NOVEL FURAN COMPOUND AND ITS USE IN FRAGRANCE FORMULATIONS International Flavors & Fragrances Inc. (US) 2025-12-10 EP disclosed
US-12428609-B2 Organoleptic compounds INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2025-09-30 US disclosed
EP-4416137-B1 A NOVEL FURAN COMPOUND AND ITS USE IN FRAGRANCE FORMULATIONS INT FLAVORS & FRAGRANCES INC (US) 2025-07-23 EP disclosed
US-20120207698-A1 NOVEL PYRIMIDINE DERIVATIVES AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2012-08-16 US disclosed
US-20120183490-A1 NOVEL 1,3-OXATHIANE COMPOUNDS AND THEIR USE IN FLAVOR AND FRAGRANCE COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2012-07-19 US disclosed
US-8114823-B2 Isomers of bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, ethyl ester and their use in perfume compositions INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2012-02-14 US disclosed
US-20120010301-A1 ORGANOLEPTIC COMPOUNDS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2012-01-12 US disclosed
US-20120004326-A1 ISOMERS OF BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID, ETHYL ESTER AND THEIR USE IN PERFUME COMPOSITIONS INTERNATIONAL FLAVORS & FRAGRANCES INC. 2012-01-05 US 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 (6 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-12590264-B2 Profragrance conjugates TRPA1, TST, HSF1 HMGB1 4234/4885KDM4E 4682/4885HSD17B10 1568/4885
US-12428609-B2 Organoleptic compounds TRPA1, TRPV1, TRPV5 HMGB1 3051/4885KDM4E 2148/4885HSD17B10 630/4885
US-20120004326-A1 ISOMERS OF BICYCLO[2.2.1]HEPT-5-ENE-2-CARBOXYLIC ACID, ETHYL ESTER AND THEIR USE IN PERFUME COMPOSITIONS ELOVL5, CYP8B1, CYP1B1 HMGB1 4647/4885KDM4E 2987/4885HSD17B10 124/4885
US-20120207698-A1 NOVEL PYRIMIDINE DERIVATIVES AND THEIR USE IN PERFUME COMPOSITIONS DPYD, TYMP, IMPDH1 HMGB1 1910/4885KDM4E 3580/4885HSD17B10 1756/4885
US-20120183490-A1 NOVEL 1,3-OXATHIANE COMPOUNDS AND THEIR USE IN FLAVOR AND FRAGRANCE COMPOSITIONS TAS1R1, TAS2R1, TAS1R3 HMGB1 3234/4885KDM4E 1298/4885HSD17B10 765/4885
US-20120010301-A1 ORGANOLEPTIC COMPOUNDS TRPA1, OR51E2, OR10J3 HMGB1 4765/4885KDM4E 475/4885HSD17B10 315/4885

“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.