SCHEMBL6907615

SCHEMBL6907615

CC(C)C1CCC(C)(CO)CC1O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.37
TRPM8 Q7Z2W7 2/20 0.37
SLC10A1 Q14973 1/20 0.32
CYP19A1 P11511 1/20 0.31
EPHX1 P07099 1/20 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
SCHEMBL584356 1.00 TRPA1 (0.37) TRPA1TRPM8SLC10A1CYP19A1EPHX1
SCHEMBL3269762 1.00 TRPA1 (0.37) TRPA1TRPM8SLC10A1CYP19A1EPHX1
SCHEMBL28317324 0.86 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL4733415 0.86 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL28252261 0.86 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL5926940 0.85 TRPA1 (0.37) TRPA1TRPM8
Water SCHEMBL6762719 0.84 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL4885149 0.84 TRPA1 (0.36) TRPA1TRPM8
SCHEMBL8088736 0.84 TRPA1 (0.36) TRPA1TRPM8
SCHEMBL27824250 0.84 TRPA1 (0.36) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040091515-A1 Noxious-insect repellent KANEBO, LTD. 2004-05-13 US disclosed
US-6686396-B2 NO OFFENSIVE ODOR AND EXHIBIT EXCELLENT NOXIOUS-INSECT REPELLING EFFECT AND DURABILITY KANEBO, LTD. (JP) 2004-02-03 US disclosed
US-6677384-B1 CARBOCYCLIC ALCOHOLS SUCH AS 2-HYDROXYMETHYL-3,3,5-TRIMETHYL-CYCLOHEXANOL USED AS ODORLESS, DURABLE LOTIONS TO PREVENT DISEASES KANEBO, LTD. (JP) 2004-01-13 US disclosed
US-20020143070-A1 Noxious-insect repellent KANEBO, LTD. 2002-10-03 US disclosed
US-6372804-B1 HYDROXYALKYLCYCLOALKANOLS REPELLENTS KANEBO, LTD. (JP) 2002-04-16 US disclosed
US-6130255-A EXPOSING NOXIOUS INSECTS TO REPELLENT COMPRISING 2-(1-HYDROXYALKYL)-CYCLOALKANOLS HAVING NO OFFENSIVE ODOR KAO CORPORATION (JP) 2000-10-10 US disclosed
US-4029759-A EDIBLE OR FOR TOPICAL APPLICATION LEVER BROTHERS COMPANY (US) 1977-06-14 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-20020143070-A1 Noxious-insect repellent OPRM1, OPRD1, L3MBTL1 TRPA1 13/4885TRPM8 156/4885SLC10A1 4631/4885
US-20040091515-A1 Noxious-insect repellent OPRM1, OPRD1, OPRK1 TRPA1 9/4885TRPM8 270/4885SLC10A1 4617/4885

“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.