SCHEMBL7546146

SCHEMBL7546146

CC(C)CC1CCCCC(C)(O)C1

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.34
GAA P10253 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 0.94 TRPA1 (0.39) TRPA1
SCHEMBL1153334 0.94 TRPA1 (0.39) TRPA1
SCHEMBL1153330 0.94 TRPA1 (0.39) TRPA1
SCHEMBL7546627 0.86 TRPA1 (0.30) TRPA1
SCHEMBL26022025 0.78 NR2F2 (0.33)
SCHEMBL7550577 0.76 TRPA1 (0.37) TRPA1
SCHEMBL102750 0.74 ESR2 (0.34)
SCHEMBL7545713 0.73 GRIN2A (0.32)
SCHEMBL24267448 0.72 TRPA1 (0.42) TRPA1
SCHEMBL12424356 0.72 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977720-B1 PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS QUEST INT (NL) 2002-06-19 EP disclosed
US-6313087-B1 PERFUME COMPOSITION COMPRISING MIXTURE OF FRAGRANCE MATERIALS, INCLUDING AT LEAST ONE 3-ALKYLCYCLOALKANOL, PROVIDING MUGUET-TYPE ODOR NOTE TO SAID COMPOSITION QUEST INTERNATIONAL BV (NL) 2001-11-06 US disclosed
EP-0977720-A1 PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS QUEST INTERNATIONAL B.V. (NL) 2000-02-09 EP disclosed
WO-1998047842-A1 PERFUMES COMPRISING 3-ALKYLCYCLOALKANOLS QUEST INTERNATIONAL B.V. (NL) 1998-10-29 WO disclosed