SCHEMBL1286871

SCHEMBL1286871

CCCCCCC(Cc1ccc(O)c(OC)c1)C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 3/20 0.59
CYP3A4 P08684 5/20 0.57
CYP2C9 P11712 5/20 0.57
CYP2C19 P33261 5/20 0.57
CYP2C8 P10632 4/20 0.57
CYP2B6 P20813 4/20 0.57
CYP1A2 P05177 4/20 0.57
CYP2D6 P10635 3/20 0.57
CYP2A6 P11509 2/20 0.57
LTA4H P09960 2/20 0.57
CYP2E1 P05181 1/20 0.57
TRPV1 Q8NER1 2/20 0.56
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
ALOX15 P16050 1/20 0.54
BLM P54132 1/20 0.54
PMP22 Q01453 1/20 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
SCHEMBL299310 1.00 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL29370506 1.00 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL3393167 1.00 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL28162513 1.00 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL29549298 1.00 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL28516417 0.99 HTR1A (0.58) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL15259679 0.95 FOS (0.54) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
SCHEMBL7758057 0.93 HTR1A (0.59) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
Undecanoate SCHEMBL28382750 0.93 CYP3A4 (0.56) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8
Nonanoate SCHEMBL29039816 0.93 CYP3A4 (0.56) HTR1ACYP3A4CYP2C9CYP2C19CYP2C8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3569671-B1 METHYLMENTHOL DERIVATIVE AND COOL-SENSATION IMPARTER COMPOSITION CONTAINING SAME TAKASAGO PERFUMERY CO LTD (JP) 2022-06-22 EP claimed
US-11344488-B2 Cool-sensation imparter composition containing 2,2,6-trimethylcyclohexanecarboxylic acid derivative TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-05-31 US claimed
US-20220154113-A1 EXPRESSION OF HETEROLOGOUS ENZYMES IN YEAST FOR FLAVOURED ALCOHOLIC BEVERAGE PRODUCTION DANSTAR FERMENT AG (CH) 2022-05-19 US claimed
US-11236042-B2 Methylmenthol derivative and cool-sensation imparter composition containing same TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-02-01 US claimed
US-20200297607-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-09-24 US claimed
EP-3699250-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE Takasago International Corporation (JP) 2020-08-26 EP claimed
US-10494330-B2 Methyl menthol derivative and cooling agent composition containing same TAKASAGO INTERNATIONAL CORPORATION (JP) 2019-12-03 US claimed
EP-3569671-A1 METHYLMENTHOL DERIVATIVE AND COOL-SENSATION IMPARTER COMPOSITION CONTAINING SAME Takasago International Corporation (JP) 2019-11-20 EP claimed
EP-3275962-B1 METHYL MENTHOL DERIVATIVE AND COOLING AGENT COMPOSITION CONTAINING SAME TAKASAGO PERFUMERY CO LTD (JP) 2019-10-02 EP claimed
CN-110168038-A Methyl menthol derivative and cold feeling agent composition containing it 高砂香料工业株式会社 2019-08-23 CN claimed
WO-2019078185-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE 高砂香料工業株式会社 2019-04-25 WO claimed
US-20180057447-A1 METHYL MENTHOL DERIVATIVE AND COOLING AGENT COMPOSITION CONTAINING SAME TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-03-01 US claimed
EP-3275962-A1 METHYL MENTHOL DERIVATIVE AND COOLING AGENT COMPOSITION CONTAINING SAME Takasago International Corporation (JP) 2018-01-31 EP claimed
CN-107532063-A Methyl menthol derivative and the cooling agent composition containing it 高砂香料工业株式会社 2018-01-02 CN claimed
EP-2184986-A2 PHARMACEUTICAL COMPOSITIONS FOR TREATING CHRONIC PAIN AND PAIN ASSOCIATED WITH NEUROPATHY Trinity Laboratories, Inc. (US) 2010-05-19 EP claimed
WO-2009021058-A2 PHARMACEUTICAL COMPOSITIONS FOR TREATING CHRONIC PAIN AND PAIN ASSOCIATED WITH NEUROPATHY TRINITY LABORTORIES, INC. (US) 2009-02-12 WO claimed
US-20260028562-A1 FLAVORED POROUS MATERIAL FOR FLAVORED BEVERAGE PRODUCTION DANSTAR FERMENT AG (CH) 2026-01-29 US disclosed
EP-4557970-A1 FLAVORED POROUS MATERIAL FOR FLAVORED BEVERAGE PRODUCTION Danstar Ferment AG (CH) 2025-05-28 EP disclosed
EP-2642287-A2 Method for evaluating sensory stimulus component Takasago International Corporation (JP) 2013-09-25 EP disclosed
WO-2012048294-A2 PHARMACEUTICAL COMPOSITIONS FOR TREATING CHRONIC PAIN AND PAIN ASSOCIATED WITH NEUROPATHY TRINITY LABORATORIES, INC. (US) 2012-04-12 WO 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-20200297607-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE CNR2, ADRB2, TRPA1 HTR1A 70/4885CYP3A4 4632/4885CYP2C9 3242/4885
US-11344488-B2 Cool-sensation imparter composition containing 2,2,6-trimethylcyclohexanecarboxylic acid derivative CNR2, ADRB2, TRPA1 HTR1A 70/4885CYP3A4 4632/4885CYP2C9 3242/4885
US-20180057447-A1 METHYL MENTHOL DERIVATIVE AND COOLING AGENT COMPOSITION CONTAINING SAME TRPM4, TAS2R41, TRPM2 HTR1A 212/4885CYP3A4 255/4885CYP2C9 951/4885
US-10494330-B2 Methyl menthol derivative and cooling agent composition containing same TRPM4, TAS2R41, TRPM2 HTR1A 212/4885CYP3A4 255/4885CYP2C9 951/4885
US-11236042-B2 Methylmenthol derivative and cool-sensation imparter composition containing same TRPM8, TRPM4, TRPM2 HTR1A 36/4885CYP3A4 1992/4885CYP2C9 1504/4885
US-20260028562-A1 FLAVORED POROUS MATERIAL FOR FLAVORED BEVERAGE PRODUCTION CD69, SORD, TAS2R13 HTR1A 2357/4885CYP3A4 1977/4885CYP2C9 2031/4885

“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.