SCHEMBL12715399

SCHEMBL12715399

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OCCOCCO

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
LMNA P02545 2/20 0.47
KDM4E B2RXH2 1/20 0.45
APOBEC3A P31941 1/20 0.45
APOBEC3G Q9HC16 1/20 0.45
GAA P10253 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TRPA1 O75762 2/20 0.42
TRPM8 Q7Z2W7 2/20 0.42
P2RX4 Q99571 1/20 0.42
NTSR1 P30989 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
EPHX1 P07099 3/20 0.41
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
CYP19A1 P11511 2/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39

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
SCHEMBL23196491 1.00 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL29230105 1.00 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL888164 1.00 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL7068032 1.00 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL1616052 0.94 ALDH1A1 (0.60) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL1617841 0.93 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL1616025 0.93 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL28140415 0.92 ALDH1A1 (0.69) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL3388061 0.91 ALDH1A1 (0.67) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G
SCHEMBL12086406 0.91 ALDH1A1 (0.67) ALDH1A1LMNAKDM4EAPOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4103287-A1 COMPOSITIONS COMPRISING (BIO)-ALKANEDIOLS AND COOLING AGENTS Symrise AG (DE) 2022-12-21 EP claimed
WO-2022122134-A1 COMPOSITIONS WITH (BIO)-ALKANEDIOLS AND COOLING AGENTS SYMRISE AG (DE) 2022-06-16 WO claimed
WO-2022122903-A1 COMPOSITIONS COMPRISING (BIO)-ALKANEDIOLS AND COOLING AGENTS SYMRISE AG (DE) 2022-06-16 WO claimed
EP-3996506-A1 FORMULATIONS FOR CONTROL AND REPELLENCY OF BITING ARTHROPODS Bedoukian Research, Inc. (US) 2022-05-18 EP claimed
EP-3996505-A1 SYNERGISTIC FORMULATIONS FOR CONTROL AND REPELLENCY OF BITING ARTHROPODS Bedoukian Research, Inc. (US) 2022-05-18 EP claimed
WO-2021071896-A1 SYNERGISTIC FORMULATIONS FOR CONTROL AND REPELLENCY OF BITING ARTHROPODS BEDOUKIAN RESEARCH, INC. (US) 2021-04-15 WO claimed
WO-2021071898-A1 FORMULATIONS FOR CONTROL AND REPELLENCY OF BITING ARTHROPODS BEDOUKIAN RESEARCH, INC. (US) 2021-04-15 WO claimed
US-12414906-B2 Compositions and methods for treating hot flashes THE PROCTER & GAMBLE COMPANY (US) 2025-09-16 US disclosed
CN-118697922-A Perfume dispersing device 弗门尼舍有限公司 2024-09-27 CN disclosed
WO-2024191278-A1 FOOD SUPPLEMENT FORMULATED TO ACT ON THE THROAT, BRONCHI AND LUNGS AZ-PHARMA LABORATOIRES (MA) 2024-09-19 WO disclosed
CN-115279328-B Structured rheological solid compositions 宝洁公司 2024-07-05 CN disclosed
US-20230293406-A1 Compositions Comprising (Bio)-Alkanediols and Cooling Agents SYMRISE AG (DE) 2023-09-21 US disclosed
CN-109414048-B Coated yeast formulation 弗门尼舍有限公司 2023-09-01 CN 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-20160339026-A1 TOPICAL COMPOSITIONS COMPRISING MODULATORS OF TRPM8 SENOMYX INC (US) 2016-11-24 US disclosed
US-7923585-B2 Menthol derivative and cooling agent composition comprising the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-04-12 US disclosed
US-7923585-B2 Menthol derivative and cooling agent composition comprising the same TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-04-12 US disclosed
US-20070225378-A1 Menthol Dearivative and Cooling Agent Composition Comprising the Same TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-09-27 US disclosed
US-20070225378-A1 Menthol Dearivative and Cooling Agent Composition Comprising the Same TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-09-27 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-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 ALDH1A1 1490/4885LMNA 4440/4885KDM4E 1061/4885
US-20230293406-A1 Compositions Comprising (Bio)-Alkanediols and Cooling Agents OR51E2, MAL2, ADH1C ALDH1A1 77/4885LMNA 4046/4885KDM4E 1483/4885
US-12414906-B2 Compositions and methods for treating hot flashes ELOVL5, ELOVL3, HCN3 ALDH1A1 1959/4885LMNA 1803/4885KDM4E 4262/4885
US-20070225378-A1 Menthol Dearivative and Cooling Agent Composition Comprising the Same TRPM7, TRPA1, TRPM2 ALDH1A1 443/4885LMNA 2154/4885KDM4E 614/4885
US-20170087199-A1 COMPOSITIONS FOR DELIVERING A COOLING SENSATION TRPA1, PDE6G, PDE6D ALDH1A1 1029/4885LMNA 4541/4885KDM4E 3662/4885
US-20160339026-A1 TOPICAL COMPOSITIONS COMPRISING MODULATORS OF TRPM8 TRPM8, TRPM7, TRPM2 ALDH1A1 3975/4885LMNA 3819/4885KDM4E 3401/4885

“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.