SCHEMBL80633

SCHEMBL80633

CC1CCCC(COCCOCC(=O)O)(C(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46

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
SCHEMBL81708 0.99 CYP1A2 (0.44) CYP1A2
SCHEMBL114682 0.93 CYP1A2 (0.49) CYP1A2
SCHEMBL5690451 0.93 CYP1A2 (0.49) CYP1A2
SCHEMBL5435198 0.93 CYP1A2 (0.49) CYP1A2
SCHEMBL28350743 0.71 CYP1A2 (0.47) CYP1A2
SCHEMBL906614 0.71 CYP1A2 (0.47) CYP1A2
SCHEMBL3722471 0.71 CYP1A2 (0.47) CYP1A2
SCHEMBL7976411 0.70 CYP1A2 (0.46) CYP1A2
SCHEMBL20772142 0.69 KDM4E (0.44) CYP1A2
SCHEMBL2295962 0.68 CYP1A2 (0.41) CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023143741-A1 NEW COOLANTS, AND PREPARATIONS CONTAINING SAME SYMRISE AG (DE) 2023-08-03 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
US-20110200545-A1 DEODORANT COMPOSITION AND METHODS FOR USE THEREOF MAN-CHEM, LLC 2011-08-18 US 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-20080000614-A1 HOT FLAVOR AND SKIN SENSATION COMPOSITION FIRMENICH SA (CH) 2008-01-03 US disclosed
EP-1682641-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2006-07-26 EP disclosed
EP-1575673-A2 USE OF A TRPM8-ACTIVATING SUBSTANCE FOR THE TREATMENT OF TUMOURS metaGen Pharmaceuticals GmbH (DE) 2005-09-21 EP disclosed
WO-2005042680-A1 FLAVOR INGREDIENTS FOR COOLING PREPARATIONS FIRMENICH SA (CH) 2005-05-12 WO disclosed
WO-2004054497-A2 USE OF A TRPM8-ACTIVATING SUBSTANCE FOR THE TREATMENT OF TUMOURS METAGEN PHARMACEUTICALS GMBH (DE) 2004-07-01 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 CYP1A2 1073/4885

“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.