Sugi Predict

Sugi Predict / Compounds / SCHEMBL11467652

SCHEMBL11467652

SCHEMBL11467652

CC/C=C/CCC(=O)OCC

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA3 P0DMS8 2/20 0.70
▸ NR1I2 O75469 2/20 0.70
▸ PTGS2 P35354 2/20 0.70
▸ PGR P06401 1/20 0.70
▸ PDE4D Q08499 1/20 0.70
▸ ALDH1A1 P00352 9/20 0.66
▸ CYP3A4 P08684 2/20 0.66
▸ ALOX15 P16050 2/20 0.66
▸ HSD17B10 Q99714 2/20 0.66
▸ TDP1 Q9NUW8 2/20 0.66
▸ TSHR P16473 1/20 0.66
▸ CYP1A2 P05177 1/20 0.52
▸ CYP19A1 P11511 4/20 0.50
▸ PPARG P37231 3/20 0.50
▸ OXER1 Q8TDS5 3/20 0.50
▸ MAPT P10636 3/20 0.50
▸ RXRA P19793 2/20 0.50
▸ FFAR1 O14842 2/20 0.50
▸ MGAM O43451 1/20 0.46
▸ GAA P10253 1/20 0.46

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
SCHEMBL11467654 1.00 ADORA3 (0.70) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL16994601 1.00 ADORA3 (0.70) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL4425859 0.94 ADORA3 (0.80) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL4984694 0.94 ADORA3 (0.80) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL15130626 0.94 ADORA3 (0.80) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL442556 0.94 ADORA3 (0.80) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL4984691 0.94 ADORA3 (0.80) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL9183882 0.93 NR1I2 (0.60) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL9183887 0.93 NR1I2 (0.60) ADORA3NR1I2PTGS2PGRPDE4D
SCHEMBL18924751 0.88 ADORA3 (0.89) 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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113462581-B Fungus for producing fragrant substances 华南农业大学 2022-07-22 — — CN claimed
CN-113462581-A Fungus for producing fragrant substances 华南农业大学 2021-10-01 — — CN claimed
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
CN-113462581-B Fungus for producing fragrant substances 华南农业大学 2022-07-22 — — CN disclosed
CN-113462581-B Fungus for producing fragrant substances 华南农业大学 2022-07-22 — — CN 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
CN-113462581-A Fungus for producing fragrant substances 华南农业大学 2021-10-01 — — CN disclosed
CN-113462581-A Fungus for producing fragrant substances 华南农业大学 2021-10-01 — — CN disclosed
US-20210227863-A1 HIGH INTENSITY SWEETENERS SENOMYX, INC. 2021-07-29 — — US 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
US-20170119032-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED 2017-05-04 — — US disclosed
WO-2017075257-A2 HIGH INTENSITY SWEETENERS SENOMYX, INC. (US) 2017-05-04 — — WO 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
US-4234741-A BENZENESELENYL HALIDE REACTANT, SELENIUM-CONTAINING INTERMEDIATES FIRMENICH, S.A. (CH) 1980-11-18 — — 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 (9 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-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-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.