SCHEMBL3479883

SCHEMBL3479883

CC1CCC(CO)C(O)C1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.45
TRPM8 Q7Z2W7 2/20 0.45
GBA1 P04062 6/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
PYGL P06737 2/20 0.32
GAA P10253 2/20 0.32
SI P14410 1/20 0.32
GBA2 Q9HCG7 1/20 0.32
GLB1 P16278 1/20 0.32
EPHX2 P34913 1/20 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
SCHEMBL22739224 0.82 TRPA1 (0.42) TRPA1TRPM8CA1CA2CA4
SCHEMBL13225335 0.82 TRPA1 (0.42) TRPA1TRPM8CA1CA2CA4
SCHEMBL3479924 0.81 TRPA1 (0.40) TRPA1TRPM8GBA1CA1CA2
SCHEMBL12159671 0.81 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL31516173 0.81 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL13916212 0.81 TRPA1 (0.40) TRPA1TRPM8GBA1CA1CA2
SCHEMBL3249131 0.81 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL27732658 0.81 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL18644147 0.81 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL899282 0.80 TRPA1 (0.33) TRPA1TRPM8GBA1SIEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767012-B2 Recording liquid, liquid cartridge, liquid discharge device, and liquid discharge method SONY CORPORATION (JP) 2010-08-03 US disclosed
US-20070139500-A1 RECORDING LIQUID, LIQUID CARTRIDGE, LIQUID DISCHARGE DEVICE, AND LIQUID DISCHARGE METHOD SONY CORPORATION (JP) 2007-06-21 US disclosed
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

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 156/4885GBA1 4407/4885
US-20040091515-A1 Noxious-insect repellent OPRM1, OPRD1, OPRK1 TRPA1 9/4885TRPM8 270/4885GBA1 4620/4885

“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.