SCHEMBL18339259

SCHEMBL18339259

CCC=CCCCC(=O)OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.62
NR1I2 O75469 2/20 0.62
PTGS2 P35354 2/20 0.62
PGR P06401 1/20 0.62
PDE4D Q08499 1/20 0.62
TSHR P16473 4/20 0.56
ALDH1A1 P00352 6/20 0.55
OXER1 Q8TDS5 4/20 0.55
F7 P08709 3/20 0.55
CYP19A1 P11511 3/20 0.55
F3 P13726 3/20 0.55
PTGS1 P23219 2/20 0.55
PPARG P37231 2/20 0.55
KMT2A Q03164 2/20 0.55
PPARD Q03181 2/20 0.55
PPARA Q07869 2/20 0.55
RXRA P19793 1/20 0.55
CYP3A4 P08684 2/20 0.54
ALOX15 P16050 2/20 0.54
HSD17B10 Q99714 2/20 0.54

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
SCHEMBL12923814 1.00 ADORA3 (0.62) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL13921384 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL983231 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL13129422 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL983228 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL983229 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL16995167 0.94 ADORA3 (0.72) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL7192944 0.94 ALDH1A1 (0.62) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL5934155 0.94 ALDH1A1 (0.62) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL31720876 0.93 ADORA3 (0.70) ADORA3NR1I2PTGS2PGRPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
US-11758933-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2023-09-19 US disclosed
EP-3368542-B1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2022-06-22 EP disclosed
US-11357246-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2022-06-14 US disclosed
US-20210227863-A1 HIGH INTENSITY SWEETENERS SENOMYX, INC. 2021-07-29 US disclosed
EP-3356356-B1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED (US) 2021-05-26 EP disclosed
CN-110818564-A Method for preparing high-carbon dibasic acid ester by using unsaturated fatty acid ester 石河子大学 2020-02-21 CN disclosed
US-10392371-B2 Compounds useful as modulators of TRPM8 SENOMYX, INC. (US) 2019-08-27 US disclosed
US-20190177308-A9 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX, INC. 2019-06-13 US disclosed
US-20180273517-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 SENOMYX INC (US) 2018-09-27 US disclosed
EP-3368542-A2 HIGH INTENSITY SWEETENERS Senomyx, Inc. (US) 2018-09-05 EP disclosed
EP-3356356-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 Senomyx, Inc. (US) 2018-08-08 EP disclosed
US-9732071-B2 Compounds useful as modulators of TRPM8 SENOMYX, INC. (US) 2017-08-15 US disclosed
US-20170143022-A1 Compositions Incorporating an Umami Flavor Agent SENOMYX INC (US) 2017-05-25 US disclosed
WO-2017075257-A2 HIGH INTENSITY SWEETENERS SENOMYX, INC. (US) 2017-05-04 WO disclosed
US-20170119032-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED 2017-05-04 US disclosed
US-20170096418-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED 2017-04-06 US disclosed
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION SENOMYX INC (US) 2017-03-30 US disclosed
US-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF SENOMYX INC (US) 2016-12-29 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 (12 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-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 ADORA3 2392/4885NR1I2 3388/4885PTGS2 2509/4885
US-20170119032-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 ADORA3 2392/4885NR1I2 3388/4885PTGS2 2509/4885
US-20160376263-A1 BITTER TASTE MODIFIERS INCLUDING SUBSTITUTED 1-BENZYL-3-(1-(ISOXAZOL-4-YLMETHYL)-1H-PYRAZOL-4-YL)IMIDAZOLIDINE-2,4-DIONES AND COMPOSITIONS THEREOF TAS2R5, TAS1R1, TAS2R1 ADORA3 666/4885NR1I2 1429/4885PTGS2 3661/4885
US-10392371-B2 Compounds useful as modulators of TRPM8 TRPM8, TRPM4, TRPM6 ADORA3 1405/4885NR1I2 1865/4885PTGS2 1615/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 ADORA3 2392/4885NR1I2 3388/4885PTGS2 2509/4885
US-20170143022-A1 Compositions Incorporating an Umami Flavor Agent TAS2R8, TAS2R45, TAS2R40 ADORA3 3048/4885NR1I2 2831/4885PTGS2 2285/4885
US-20190177308-A9 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 ADORA3 1057/4885NR1I2 2303/4885PTGS2 1259/4885
US-20180273517-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 ADORA3 1057/4885NR1I2 2303/4885PTGS2 1259/4885
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION TRPA1, PDE6G, PDE6D ADORA3 956/4885NR1I2 1269/4885PTGS2 722/4885
US-20210227863-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 ADORA3 2392/4885NR1I2 3388/4885PTGS2 2509/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 ADORA3 2392/4885NR1I2 3388/4885PTGS2 2509/4885
US-20170096418-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 ADORA3 1057/4885NR1I2 2303/4885PTGS2 1259/4885

“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.