SCHEMBL4582936

SCHEMBL4582936

CC1CCOC(C(C)C)CC1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.31
TRPM8 Q7Z2W7 2/20 0.31

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
SCHEMBL14198486 1.00 TRPA1 (0.31) TRPA1TRPM8
SCHEMBL14198491 1.00 TRPA1 (0.31) TRPA1TRPM8
SCHEMBL14198488 1.00 TRPA1 (0.31) TRPA1TRPM8
SCHEMBL14198490 1.00 TRPA1 (0.31) TRPA1TRPM8
SCHEMBL777278 0.84
SCHEMBL801070 0.84
SCHEMBL777224 0.84
SCHEMBL11262685 0.81 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL15781003 0.81 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL15780982 0.81 TRPA1 (0.35) TRPA1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1923389-A1 2-Isopropyl-5-methyloxepan and its use as fragrance compound Symrise GmbH & Co. KG (DE) 2008-05-21 EP claimed
CN-105683245-B Cross-linking of double-bond-containing polyethercarbonate polyols by addition of mercapto compounds 科思创德国股份有限公司 2019-10-22 CN disclosed
CN-105899572-B Branched polyether carbonate polyols and process for their preparation 科思创德国股份有限公司 2018-12-28 CN disclosed
US-9365530-B2 Direct anti-markovnikov addition of acids to alkenes THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-06-14 US disclosed
US-9365530-B2 Direct anti-markovnikov addition of acids to alkenes THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2016-06-14 US disclosed
US-20150133680-A1 DIRECT ANTI-MARKOVNIKOV ADDITION OF ACIDS TO ALKENES UNIV NORTH CAROLINA (US) 2015-05-14 US disclosed
US-20150133680-A1 DIRECT ANTI-MARKOVNIKOV ADDITION OF ACIDS TO ALKENES UNIV NORTH CAROLINA (US) 2015-05-14 US disclosed
EP-1923389-A1 2-Isopropyl-5-methyloxepan and its use as fragrance compound Symrise GmbH & Co. KG (DE) 2008-05-21 EP disclosed
EP-1923389-A1 2-Isopropyl-5-methyloxepan and its use as fragrance compound Symrise GmbH & Co. KG (DE) 2008-05-21 EP disclosed
EP-1923389-A1 2-Isopropyl-5-methyloxepan and its use as fragrance compound Symrise GmbH & Co. KG (DE) 2008-05-21 EP disclosed
EP-1923389-A1 2-Isopropyl-5-methyloxepan and its use as fragrance compound Symrise GmbH & Co. KG (DE) 2008-05-21 EP 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-20150133680-A1 DIRECT ANTI-MARKOVNIKOV ADDITION OF ACIDS TO ALKENES HAO2, PDK2, DUOX2 TRPA1 4276/4885TRPM8 4086/4885

“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.