SCHEMBL1153330

SCHEMBL1153330

CC(C)C[C@H]1CCC[C@](C)(O)C1

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.39
CYP1A2 P05177 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL1153332 1.00 TRPA1 (0.39) TRPA1CYP1A2L3MBTL1
SCHEMBL1153334 1.00 TRPA1 (0.39) TRPA1CYP1A2L3MBTL1
SCHEMBL7546146 0.94 TRPA1 (0.34) TRPA1
SCHEMBL7546627 0.88 TRPA1 (0.30) TRPA1
SCHEMBL7550577 0.81 TRPA1 (0.37) TRPA1
SCHEMBL26022025 0.79 NR2F2 (0.33)
SCHEMBL7545713 0.78 GRIN2A (0.32)
SCHEMBL24267448 0.78 TRPA1 (0.42) TRPA1
SCHEMBL21961597 0.78 TRPA1 (0.42) TRPA1
SCHEMBL21947333 0.78 TRPA1 (0.42) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7884065-B2 perfumes having rose and geranium notes SYMRISE AG (DE) 2011-02-08 US disclosed
US-20100130397-A1 4-Isoamylcyclohexanol as Odiferant SYMRISE GMBH & CO. KG (DE) 2010-05-27 US disclosed
EP-1797025-B1 4-ISOAMYLCYCLOHEXANOL AS ODIFERANT SYMRISE GMBH & CO KG (DE) 2008-08-13 EP disclosed
EP-1797025-A1 4-ISOAMYLCYCLOHEXANOL AS ODIFERANT Symrise GmbH & Co. KG (DE) 2007-06-20 EP disclosed
WO-2006035010-A1 4-ISOAMYLCYCLOHEXANOL AS ODIFERANT SYMRISE GMBH & CO. KG (DE) 2006-04-06 WO disclosed