SCHEMBL4933865

SCHEMBL4933865

CC(=O)OCCC1=CC[C@H]2C[C@@H]1C2(C)C

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.55
TDP1 Q9NUW8 4/20 0.47
TSHR P16473 2/20 0.47
KDM4E B2RXH2 2/20 0.47
HTT P42858 1/20 0.47
MAPK1 P28482 2/20 0.45
CXCR3 P49682 8/20 0.42
SCN9A Q15858 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1866120 1.00 KCNH2 (0.55) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL17627703 1.00 KCNH2 (0.55) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL17627701 1.00 KCNH2 (0.55) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL9723550 1.00 KCNH2 (0.55) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL132597 1.00 KCNH2 (0.55) KCNH2TDP1TSHRKDM4EHTT
Acetic Acid SCHEMBL15140921 0.97 KCNH2 (0.53) KCNH2TDP1TSHRKDM4EHTT
Acetic Acid SCHEMBL14763969 0.97 KCNH2 (0.53) KCNH2TDP1TSHRKDM4EHTT
Nopol SCHEMBL7657549 0.95 KCNH2 (0.51) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL930939 0.90 KCNH2 (0.47) KCNH2TDP1TSHRKDM4EHTT
SCHEMBL10824629 0.87 KCNH2 (0.51) KCNH2TDP1TSHRKDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1894603-B1 Encapsulation of bulky fragrance molecules TAKASAGO PERFUMERY CO LTD (JP) 2014-11-19 EP claimed
WO-2025202258-A1 IMPROVEMENTS IN OR RELATING TO ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2025-10-02 WO disclosed
WO-2024175905-A1 DIMER COMPOUNDS Kesmalea Therapeutics Limited (GB) 2024-08-29 WO disclosed
US-10836985-B2 Solid composition comprising free and encapsulated fragrances TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-11-17 US disclosed
EP-3282003-B1 SOLID COMPOSITION COMPRISING FREE AND ENCAPSULATED FRAGRANCES TAKASAGO PERFUMERY CO LTD (JP) 2020-09-02 EP disclosed
US-20200190445-A1 SOLID COMPOSITION COMPRISING FREE AND ENCAPSULATED FRAGRANCES TAKASAGO INTERNATIONAL CORPORATION (JP) 2020-06-18 US disclosed
EP-2832441-B1 MICROCAPSULES TAKASAGO PERFUMERY CO LTD (JP) 2019-09-11 EP disclosed
CN-105431225-B Microcapsule 高砂香料工业株式会社 2018-06-08 CN disclosed
US-9895297-B2 Microcapsules TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-02-20 US disclosed
WO-2018030431-A1 SOLID COMPOSITION COMPRISING FREE AND ENCAPSULATED FRAGRANCES TAKASAGO INTERNATIONAL CORPORATION (JP) 2018-02-15 WO disclosed
CN-105431225-A Microcapsule TAKASAGO PERFUMERY CO LTD 2016-03-23 CN disclosed
WO-2015016369-A1 MICROCAPSULES TAKASAGO INTERNATIONAL CORPORATION (JP) 2015-02-05 WO disclosed
EP-2832441-A1 Microcapsules Takasago International Corporation (JP) 2015-02-04 EP disclosed
EP-1894603-B1 Encapsulation of bulky fragrance molecules TAKASAGO PERFUMERY CO LTD (JP) 2014-11-19 EP disclosed
US-8609600-B2 Encapsulation of bulky fragrance molecules TAKASAGO INTERNATIONAL CORPORATION (JP) 2013-12-17 US disclosed
EP-2620211-A2 New microcapsules Takasago International Corporation (JP) 2013-07-31 EP disclosed
US-20110308555-A1 PERFUME SYSTEMS PROCTER & GAMBLE COMPANY, THE 2011-12-22 US disclosed
US-20080176780-A1 ENCAPSULATION OF BULKY FRAGRANCE MOLECULES TAKASAGO INTERNATIONAL CORPORATION (JP) 2008-07-24 US disclosed
EP-1894603-A1 Encapsulation of bulky fragrance molecules Takasago International Corporation (JP) 2008-03-05 EP disclosed
US-5175347-A Hydogenation of a ester compound in presence of hydrogen using solid catalyst KALI-CHEMIE PHARMA GMBH (DE) 1992-12-29 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 (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-20110308555-A1 PERFUME SYSTEMS TRPA1, PORCN, PLIN5 KCNH2 1417/4885TDP1 2408/4885TSHR 4787/4885

“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.