SCHEMBL80852

SCHEMBL80852

CC1CCC(C(C)C)C(C(OCCO)C(=O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.42
TRPM8 Q7Z2W7 5/20 0.40
TRPA1 O75762 2/20 0.40
ALDH1A1 P00352 2/20 0.38
CYP19A1 P11511 2/20 0.36
TRPV1 Q8NER1 2/20 0.34
HPGD P15428 1/20 0.34
P2RX4 Q99571 1/20 0.33

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
SCHEMBL29561496 1.00 EPHX1 (0.42) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL16041029 0.92 EPHX1 (0.38) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL583663 0.87 EPHX1 (0.41) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL8375721 0.85 TRPM8 (0.47) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL30772345 0.84 EPHX1 (0.38) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL5690453 0.80 EPHX1 (0.47) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL583712 0.80 EPHX1 (0.47) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL18280698 0.75 EPHX1 (0.45) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL19209892 0.74 EPHX1 (0.47) EPHX1TRPM8TRPA1ALDH1A1CYP19A1
SCHEMBL19753622 0.74 EPHX1 (0.55) EPHX1TRPM8TRPA1ALDH1A1CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014198366-A1 GLOVE WITH A COOLING EFFECT CARL FREUDENBERG KG (DE) 2014-12-18 WO claimed
EP-2276356-B1 WARMING SENSATE COMPOSITION FIRMENICH & CIE (CH) 2013-06-19 EP claimed
EP-2276356-A1 WARMING SENSATE COMPOSITION Firmenich S.A. (CH) 2011-01-26 EP claimed
US-20110015227-A1 WARMING SENSATE COMPOSITION FIRMENICH SA (CH) 2011-01-20 US claimed
JP-4608499-B2 2011-01-12 JP claimed
WO-2009127992-A1 WARMING SENSATE COMPOSITION FIRMENICH SA (CH) 2009-10-22 WO claimed
EP-1874132-A1 HOT FLAVOUR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2008-01-09 EP claimed
US-20080000614-A1 HOT FLAVOR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2008-01-03 US claimed
JP-2007516316-A 2007-06-21 JP claimed
WO-2006109241-A1 HOT FLAVOUR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2006-10-19 WO claimed
EP-1682641-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2006-07-26 EP claimed
WO-2005042680-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2005-05-12 WO claimed
WO-2014198366-A1 GLOVE WITH A COOLING EFFECT CARL FREUDENBERG KG (DE) 2014-12-18 WO disclosed
WO-2011056748-A2 ORAL COMPOSITIONS FOR TREATMENT OF DRY MOUTH THE PROCTER & GAMBLE COMPANY (US) 2011-05-12 WO disclosed
WO-2009065239-A1 COMPOSITIONS AND THEIR USE GIVAUDAN SA (CH) 2009-05-28 WO disclosed
EP-1874132-A1 HOT FLAVOUR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2008-01-09 EP disclosed
US-20060249167-A1 Flavor ingredients for cooling preparations FIRMENICH SA (CH) 2006-11-09 US disclosed
WO-2006109241-A1 HOT FLAVOUR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2006-10-19 WO disclosed
EP-1682641-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2006-07-26 EP disclosed
WO-2005042680-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2005-05-12 WO 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-20110015227-A1 WARMING SENSATE COMPOSITION TAS1R3, TAS2R30, TAS2R50 EPHX1 3988/4885TRPM8 76/4885TRPA1 28/4885

“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.