SCHEMBL3240918

SCHEMBL3240918

CCNC(=O)C(C)(C(C)C)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 2/20 0.34
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
KMT2A Q03164 1/20 0.33
PIK3CD O00329 1/20 0.33
CHRNB2 P17787 1/20 0.32
CHRNB4 P30926 1/20 0.32
CHRNA3 P32297 1/20 0.32
CHRNA4 P43681 1/20 0.32
MCL1 Q07820 1/20 0.32
CAPN1 P07384 1/20 0.32
FAAH O00519 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 2/20 0.30

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
SCHEMBL5807533 0.86 PIK3CD (0.33) MMP8PIK3CDCYP2D6CYP2C19ALDH1A1
SCHEMBL12449353 0.82 KDM4C (0.42) MMP1MMP2MMP3MMP9KMT2A
SCHEMBL18907822 0.81 MMP8 (0.34) MMP8MMP1MMP2MMP3MMP9
SCHEMBL2487164 0.80
SCHEMBL18287163 0.79 PIK3CD (0.32) PIK3CDCYP2D6CYP2C19
SCHEMBL18287159 0.79 FAAH (0.34) FAAHCYP2D6CYP2C19TSHRUSP2
SCHEMBL291397 0.77 ALDH1A1 (0.41) KMT2APIK3CDCHRNB2CHRNB4CHRNA3
SCHEMBL18287157 0.76 ANPEP (0.42) MMP8MMP2KMT2ASMN1; SMN2
SCHEMBL18287161 0.76 EPHX1 (0.59) MMP8KMT2AFAAHSMN1; SMN2
SCHEMBL11339189 0.76 GAA (0.49) MMP8CYP2C19SMN1; SMN2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105168009-A Water-soluble dropping pills containing compound cooling agent and preparation method of dropping pills ANHUI FENGLE PERFUME CO LTD 2015-12-23 CN claimed
US-4296255-A USEFUL IN TOILETRIES WILKINSON SWORD LIMITED (GB) 1981-10-20 US claimed
US-11344488-B2 Cool-sensation imparter composition containing 2,2,6-trimethylcyclohexanecarboxylic acid derivative TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-05-31 US disclosed
EP-2844094-B1 SMOKING ARTICLE MOUTHPIECE WITH COOLING AGENT INCLUSION COMPLEX PHILIP MORRIS PRODUCTS SA (CH) 2021-01-27 EP disclosed
US-20200297607-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-09-24 US disclosed
EP-3699250-A1 COOL-SENSATION IMPARTER COMPOSITION CONTAINING 2,2,6-TRIMETHYLCYCLOHEXANECARBOXYLIC ACID DERIVATIVE Takasago International Corporation (JP) 2020-08-26 EP disclosed
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 disclosed
US-20180220699-A1 SMOKING ARTICLE MOUTHPIECE WITH COOLING AGENT INCLUSION COMPLEX PHILIP MORRIS PRODUCTS S.A. (CH) 2018-08-09 US disclosed
US-20180220699-A1 SMOKING ARTICLE MOUTHPIECE WITH COOLING AGENT INCLUSION COMPLEX PHILIP MORRIS PRODUCTS S.A. (CH) 2018-08-09 US disclosed
US-9949505-B2 Smoking article mouthpiece with cooling agent inclusion complex PHILIP MORRIS PRODUCTS S.A. (CH) 2018-04-24 US disclosed
US-9949505-B2 Smoking article mouthpiece with cooling agent inclusion complex PHILIP MORRIS PRODUCTS S.A. (CH) 2018-04-24 US disclosed
US-20070202212-A1 CHEWING GUM CONTAINING CONTROLLED RELEASE ACYCLIC CARBOXAMIDES WM. WRIGLEY JR. COMPANY 2007-08-30 US disclosed
US-20070092553-A1 Compositions and methods of making rapidly dissolving lonically masked formulations PFAB LP (US) 2007-04-26 US disclosed
EP-1011643-A4 CHEWING GUM CONTAINING CONTROLLED RELEASE ACYCLIC CARBOXAMIDES WRIGLEY W M JUN CO (US) 2004-10-20 EP disclosed
US-20030082271-A1 Chewing gum containing controlled release acyclic carboxamides WM. WRIGLEY, JR. COMPANY 2003-05-01 US disclosed
EP-1011643-A1 CHEWING GUM CONTAINING CONTROLLED RELEASE ACYCLIC CARBOXAMIDES WM. WRIGLEY JR. COMPANY (US) 2000-06-28 EP disclosed
WO-1999013870-A1 CHEWING GUM CONTAINING CONTROLLED RELEASE ACYCLIC CARBOXAMIDES WM. WRIGLEY JR. COMPANY (US) 1999-03-25 WO disclosed
US-4296255-A USEFUL IN TOILETRIES WILKINSON SWORD LIMITED (GB) 1981-10-20 US disclosed
US-4230688-A FOODS, TOILETRIES WILKINSON SWORD LIMITED (GB) 1980-10-28 US disclosed
US-4153679-A IN TOILETRIES, FOODS, BEVERAGES AND TOBACCO PRODUCTS WILKINSON SWORD LIMITED (GB) 1979-05-08 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 (2 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 MMP8 1384/4885MMP1 920/4885MMP2 4587/4885
US-11344488-B2 Cool-sensation imparter composition containing 2,2,6-trimethylcyclohexanecarboxylic acid derivative CNR2, ADRB2, TRPA1 MMP8 1384/4885MMP1 920/4885MMP2 4587/4885

“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.