SCHEMBL2209155

SCHEMBL2209155

CC(C)/C=C/CCCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.52
PPARD Q03181 5/20 0.52
PPARA Q07869 5/20 0.52
TOP1 P11387 3/20 0.52
CYP19A1 P11511 3/20 0.52
KMT2A Q03164 3/20 0.52
F7 P08709 3/20 0.52
F3 P13726 3/20 0.52
ALDH1A1 P00352 2/20 0.52
ADORA3 P0DMS8 2/20 0.52
PTGS1 P23219 2/20 0.52
RXRA P19793 1/20 0.52
OXER1 Q8TDS5 1/20 0.52
MAPT P10636 3/20 0.50
FABP4 P15090 3/20 0.50
BLM P54132 3/20 0.50
HSD17B10 Q99714 3/20 0.50
USP2 O75604 2/20 0.50
LMNA P02545 2/20 0.50
ALOX15 P16050 2/20 0.50

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
SCHEMBL2209161 1.00 PPARG (0.52) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL3338606 0.94 PPARG (0.57) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2208064 0.94 PPARG (0.57) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2208066 0.94 PPARG (0.57) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2206876 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL22555583 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2208734 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2206761 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2206758 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1
SCHEMBL2208737 0.92 PPARG (0.60) PPARGPPARDPPARATOP1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025229086-A1 ADHESIVE COSMETIC COMPOUNDS AND USES THEREOF SKINOSIVE (FR) 2025-11-06 WO disclosed
US-8765809-B2 Ester derivative and use thereof AJINOMOTO CO., INC. (JP) 2014-07-01 US disclosed
US-20130053441-A1 NOVEL ESTER DERIVATIVE AND USE THEREOF AJINOMOTO CO., INC. (JP) 2013-02-28 US disclosed
US-8212068-B2 Ester derivative and use thereof AJINOMOTO CO., INC. (JP) 2012-07-03 US disclosed
US-7981460-B2 Substituted benzyl ester derivative and use thereof AJINOMOTO CO., INC. (JP) 2011-07-19 US disclosed
US-7981460-B2 Substituted benzyl ester derivative and use thereof AJINOMOTO CO., INC. (JP) 2011-07-19 US disclosed
US-7981460-B2 Substituted benzyl ester derivative and use thereof AJINOMOTO CO., INC. (JP) 2011-07-19 US disclosed
US-20090203774-A1 SUBSTITUTED BENZYL ESTER DERIVATIVE AND USE THEREOF AJINOMOTO CO., INC. (JP) 2009-08-13 US disclosed
US-20090203774-A1 SUBSTITUTED BENZYL ESTER DERIVATIVE AND USE THEREOF AJINOMOTO CO., INC. (JP) 2009-08-13 US disclosed
US-20090203774-A1 SUBSTITUTED BENZYL ESTER DERIVATIVE AND USE THEREOF AJINOMOTO CO., INC. (JP) 2009-08-13 US disclosed
US-20090170942-A1 ESTER DERIVATIVE AND USE THEREOF AJINOMOTO CO. INC (JP) 2009-07-02 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 (3 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-20130053441-A1 NOVEL ESTER DERIVATIVE AND USE THEREOF MEP1A, CES2, MEP1B PPARG 3028/4885PPARD 2917/4885PPARA 3190/4885
US-20090170942-A1 ESTER DERIVATIVE AND USE THEREOF MEP1A, CES2, F8 PPARG 3257/4885PPARD 3272/4885PPARA 3435/4885
US-20090203774-A1 SUBSTITUTED BENZYL ESTER DERIVATIVE AND USE THEREOF MEP1B, EBP, MEP1A PPARG 1794/4885PPARD 2190/4885PPARA 2450/4885

“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.