SCHEMBL272455

SCHEMBL272455

CC=CC(=O)OC1CC(C)CC(C)(C)C1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
ALDH1A1 P00352 3/20 0.49
CYP3A4 P08684 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
NR1I2 O75469 1/20 0.47
ABCB11 O95342 1/20 0.47
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CTDSP1 Q9GZU7 1/20 0.34
HTT P42858 1/20 0.30
PPP1CA P62136 1/20 0.30

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
SCHEMBL272454 1.00 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL272987 1.00 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL272988 1.00 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL272986 1.00 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL4150689 0.86 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL4150683 0.86 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL36902 0.82 LMNA (0.50) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL21838748 0.82 LMNA (0.50) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL28554962 0.82 LMNA (0.50) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
SCHEMBL273063 0.81 LMNA (0.49) LMNAALDH1A1CYP3A4CYP1A2CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133856-B2 Cis-3,3,5-trimethylcyclohexyl esters SYMRISE AG (DE) 2012-03-13 US claimed
EP-1648526-B1 CIS-3,3,5-TRIMETHYLCYCLOHEXYL ESTERS SYMRISE GMBH & CO KG (DE) 2009-09-09 EP claimed
US-20060211597-A1 Cis-3,3,5-trimethylcyclohexyl esters SYMRISE AG (DE) 2006-09-21 US claimed
US-20030068295-A1 Odor neutralizers SYMRISE AG (DE) 2003-04-10 US claimed
EP-1239890-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2002-09-18 EP claimed
WO-2001043784-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2001-06-21 WO claimed
US-4508884-A COPOLYMER OF UNSATURATED SILICONE ESTER, UNSATURATED ESTER, HYDROP COOPERVISION, INC. (US) 1985-04-02 US claimed
EP-3661567-A1 SCENT SWITCH DEVICE Symrise AG (DE) 2020-06-10 EP disclosed
US-20200171194-A1 SCENT SWITCH DEVICE SYMRISE AG (DE) 2020-06-04 US disclosed
WO-2019025007-A1 SCENT SWITCH DEVICE SYMRISE AG (DE) 2019-02-07 WO disclosed
US-8133856-B2 Cis-3,3,5-trimethylcyclohexyl esters SYMRISE AG (DE) 2012-03-13 US disclosed
EP-2346535-A1 MALODOR CONTROL SYSTEM The Procter & Gamble Company (US) 2011-07-27 EP disclosed
WO-2010053891-A1 MALODOR CONTROL SYSTEM THE PROCTER & GAMBLE COMPANY (US) 2010-05-14 WO disclosed
US-7157411-B2 Odor neutralizers SYMRISE GMBH & CO. KG (DE) 2007-01-02 US disclosed
US-20060211597-A1 Cis-3,3,5-trimethylcyclohexyl esters SYMRISE AG (DE) 2006-09-21 US disclosed
EP-1239890-B1 ODOR NEUTRALIZERS SYMRISE GMBH & CO KG (DE) 2004-11-10 EP disclosed
US-20030068295-A1 Odor neutralizers SYMRISE AG (DE) 2003-04-10 US disclosed
EP-1239890-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2002-09-18 EP disclosed
WO-2001043784-A2 ODOR NEUTRALIZERS HAARMANN & REIMER GMBH (DE) 2001-06-21 WO disclosed
US-4508884-A COPOLYMER OF UNSATURATED SILICONE ESTER, UNSATURATED ESTER, HYDROP COOPERVISION, INC. (US) 1985-04-02 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 (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-20030068295-A1 Odor neutralizers OXER1, OR51E2, OR10J3 LMNA 3855/4885ALDH1A1 581/4885CYP3A4 504/4885

“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.