SCHEMBL6907572

SCHEMBL6907572

CC1(C)[C@@H]2CC[C@]1(C)[C@@H](O)C2CO

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.36
DPP4 P27487 1/20 0.35
GBA1 P04062 2/20 0.33
UGT2B7 P16662 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
SCHEMBL6907574 1.00 CNR2 (0.36) CNR2DPP4GBA1UGT2B7
SCHEMBL638375 0.78 DPP4 (0.40) CNR2DPP4
SCHEMBL504002 0.78 DPP4 (0.40) CNR2DPP4
SCHEMBL1285599 0.78 DPP4 (0.40) CNR2DPP4
SCHEMBL10406290 0.74 CNR2 (0.36) CNR2
SCHEMBL29761172 0.74 CNR2 (0.36) CNR2DPP4
SCHEMBL30148076 0.74 CNR2 (0.36) CNR2DPP4
SCHEMBL1668635 0.74 CNR2 (0.36) CNR2DPP4
SCHEMBL5407267 0.74 CNR2 (0.36) CNR2DPP4
SCHEMBL1668637 0.74 CNR2 (0.36) CNR2DPP4

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 6 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

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 CNR2 32/4885DPP4 4040/4885GBA1 4407/4885
US-20040091515-A1 Noxious-insect repellent OPRM1, OPRD1, OPRK1 CNR2 45/4885DPP4 4627/4885GBA1 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.