SCHEMBL2005576

SCHEMBL2005576

CCC(=O)OC1CCC(C)=CC1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM1 P11229 2/20 0.40
CHRM3 P20309 2/20 0.40
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
LMNA P02545 2/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
BCHE P06276 1/20 0.33
CYP19A1 P11511 3/20 0.32
ABCB1 P08183 2/20 0.32
TAS2R46 P59540 2/20 0.32

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
SCHEMBL28030332 0.83 TAS2R46 (0.39) CHRM2CHRM4CHRM1CHRM3LMNA
SCHEMBL15462384 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5930166 0.74 APOBEC3A (0.34) APOBEC3AAPOBEC3GLMNAALDH1A1POLB
SCHEMBL28858253 0.72 ACHE (0.37) ALDH1A1
SCHEMBL8031761 0.71 MEN1 (0.31) ALDH1A1
SCHEMBL28129853 0.70 CHRM2 (0.53) CHRM2CHRM4CHRM1CHRM3APOBEC3A
SCHEMBL2482943 0.70 APOBEC3A (0.32) APOBEC3AAPOBEC3GLMNAALDH1A1POLB
SCHEMBL22832664 0.69 ALDH1A1 (0.34) APOBEC3AAPOBEC3GLMNAALDH1A1POLB
SCHEMBL28025682 0.69 CHRM2 (0.41) CHRM2CHRM4CHRM1CHRM3LMNA
SCHEMBL29315039 0.68 CHRM2 (0.47) CHRM2CHRM4CHRM1CHRM3APOBEC3A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113316398-B Seamless capsule, filter and smoking article comprising same 三生医药株式会社 2024-06-11 CN disclosed
CN-118159258-A Composition containing caryophyllene 三生医药株式会社 2024-06-07 CN disclosed
CN-117120042-A Seamless capsule capable of stably disintegrating even in high-temperature and high-humidity environment and method for producing same 森下仁丹株式会社 2023-11-24 CN disclosed
US-20230200435-A1 CARYOPHYLLENE-CONTAINING AGENT OR COMPOSITION AND VARIOUS APPLICATIONS THEREOF KINKI UNIVERSITY (JP) 2023-06-29 US disclosed
CN-113316398-A Seamless capsule, filter and smoking article comprising same 三生医药株式会社 2021-08-27 CN disclosed
US-10015984-B2 Disintegrable capsule, manufacturing method for same, and smoking device containing said disintegrable capsule SUNSHO PHARMACEUTICAL CO., LTD. (JP) 2018-07-10 US disclosed
EP-2997837-A1 DISINTEGRABLE CAPSULE, MANUFACTURING METHOD FOR SAME, AND SMOKING EQUIPMENT CONTAINING SAID DISINTEGRABLE CAPSULE Sunsho Pharmaceutical Co., Ltd. (JP) 2016-03-23 EP disclosed
CN-103732060-B Antimicrobial compositions TAKASAGO INTERNATIONAL CORP. (JP) 2016-02-17 CN disclosed
US-20160021927-A1 DISINTEGRABLE CAPSULE, MANUFACTURING METHOD FOR SAME, AND SMOKING EQUIPMENT CONTAINING SAID DISINTEGRABLE CAPSULE SUNSHO PHARMACEUTICAL CO., LTD. (JP) 2016-01-28 US disclosed
US-20140163099-A1 ANTIMICROBIAL COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-06-12 US disclosed
EP-2725900-A1 ANTIMICROBIAL COMPOSITION Takasago International Corporation (JP) 2014-05-07 EP disclosed
CN-102357061-B Fragrance composition KAO CORP 2013-09-04 CN disclosed
WO-2013002421-A1 ANTIMICROBIAL COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-01-03 WO disclosed
US-20130005807-A1 ANTIMICROBIAL COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-01-03 US disclosed
US-7964637-B2 Process for producing optically active theaspirane TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-06-21 US disclosed
CN-101579292-A Perfume composition KAO CORP (JP) 2009-11-18 CN disclosed
US-20090270516-A1 Process for Producing Optically Active Theaspirane TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-29 US disclosed
CN-100522127-C Perfume composition KAO CORP (JP) 2009-08-05 CN disclosed
CN-1674862-A Perfume composition KAO CORP (JP) 2005-09-28 CN 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 (1 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-20090270516-A1 Process for Producing Optically Active Theaspirane DHPS, ALDH7A1, FASN CHRM2 4303/4885CHRM4 3819/4885CHRM1 3650/4885

“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.