SCHEMBL18339149

SCHEMBL18339149

CCCCC=CCCCC1CCCC(=O)O1

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.58
PPARG P37231 2/20 0.42
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.38
EPHX2 P34913 1/20 0.36
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
TP53 P04637 1/20 0.34
CCR6 P51684 1/20 0.34

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
SCHEMBL5333967 1.00 CYP1A2 (0.58) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL18339184 0.91 CYP1A2 (0.50) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL15067478 0.90 CYP1A2 (0.56) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL918003 0.87 CYP1A2 (0.69) CYP1A2PPARGALDH1A1TP53
SCHEMBL9192649 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL114875 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL8167761 0.85 CYP1A2 (0.77) CYP1A2PPARGALDH1A1
SCHEMBL31047999 0.84 CYP1A2 (0.66) CYP1A2PPARGALDH1A1TSHREPHX2
SCHEMBL17987905 0.84 CYP1A2 (0.49) CYP1A2PPARGALDH1A1TSHR
SCHEMBL31048000 0.84 CYP1A2 (0.66) CYP1A2PPARGALDH1A1TSHREPHX2

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-118063998-A LED (light-emitting diode) cured tin printing black ink 广东然顿环保新材料有限公司 2024-05-24 CN disclosed
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
EP-3416729-B1 PRO-FRAGRANCE COMPOSITION AQDOT LTD (GB) 2023-09-20 EP 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
CN-108601958-B Pro-fragrance compositions 爱客多有限公司 2022-06-17 CN 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
CN-108473484-B Compounds useful as TRPM8 modulators 弗门尼舍公司 2021-06-29 CN disclosed
EP-3356356-B1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED (US) 2021-05-26 EP 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
WO-2017141030-A1 PRO-FRAGRANCE COMPOSITION AQDOT LIMITED (GB) 2017-08-24 WO 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 (10 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 CYP1A2 4564/4885PPARG 217/4885ALDH1A1 978/4885
US-20170119032-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 CYP1A2 4564/4885PPARG 217/4885ALDH1A1 978/4885
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 CYP1A2 2167/4885PPARG 102/4885ALDH1A1 1490/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 CYP1A2 4564/4885PPARG 217/4885ALDH1A1 978/4885
US-20170143022-A1 Compositions Incorporating an Umami Flavor Agent TAS2R8, TAS2R45, TAS2R40 CYP1A2 2495/4885PPARG 578/4885ALDH1A1 263/4885
US-20180273517-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 CYP1A2 4547/4885PPARG 1416/4885ALDH1A1 3880/4885
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION TRPA1, PDE6G, PDE6D CYP1A2 1422/4885PPARG 111/4885ALDH1A1 1029/4885
US-20210227863-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 CYP1A2 4564/4885PPARG 217/4885ALDH1A1 978/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 CYP1A2 4564/4885PPARG 217/4885ALDH1A1 978/4885
US-20170096418-A1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 TRPM8, TRPM6, TRPM4 CYP1A2 4547/4885PPARG 1416/4885ALDH1A1 3880/4885

“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.