SCHEMBL1396802

SCHEMBL1396802

CC(O)COC(C)C1CCCC(C)(C)C1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.33
TDO2 P48775 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
SCHEMBL869451 0.87
SCHEMBL4660459 0.81
SCHEMBL1396809 0.81 IDO1 (0.30) IDO1TDO2
SCHEMBL9658110 0.80 TSHR (0.32)
SCHEMBL9356975 0.80
SCHEMBL4660494 0.79
SCHEMBL9659478 0.79
SCHEMBL9353048 0.78 IDO1 (0.32) IDO1TDO2
SCHEMBL1396769 0.78 CYP1A2 (0.34)
SCHEMBL22578964 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2200701-B1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS GIVAUDAN SA (CH) 2011-03-02 EP claimed
US-20100209378-A1 Dimethylcyclohexyl Derivatives as Malodor Neutralizers GIVAUDAN SA (CH) 2010-08-19 US claimed
EP-2200701-A1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS Givaudan SA (CH) 2010-06-30 EP claimed
WO-2009030059-A1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS GIVAUDAN SA (CH) 2009-03-12 WO claimed
EP-2200701-B1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS GIVAUDAN SA (CH) 2011-03-02 EP disclosed
US-20100209378-A1 Dimethylcyclohexyl Derivatives as Malodor Neutralizers GIVAUDAN SA (CH) 2010-08-19 US disclosed
EP-2200701-A1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS Givaudan SA (CH) 2010-06-30 EP disclosed
WO-2009030059-A1 DIMETHYLCYCLOHEXYL DERIVATIVES AS MALODOR NEUTRALIZERS GIVAUDAN SA (CH) 2009-03-12 WO disclosed
EP-0472966-B1 Esters and their use in perfumery FIRMENICH & CIE (CH) 1994-09-28 EP disclosed
US-5166412-A ESTERS AND THEIR USE IN PERFUMERY FIRMENICH S.A. (CH) 1992-11-24 US disclosed
EP-0472966-A1 Esters and their use in perfumery FIRMENICH SA (CH) 1992-03-04 EP 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-20100209378-A1 Dimethylcyclohexyl Derivatives as Malodor Neutralizers ME1, MAL2, LPO IDO1 1811/4885TDO2 590/4885

“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.