Linalyl Acetate

Linalyl Acetate

SCHEMBL1234147

C=CC(C)(CCC=C(C)C)OC(C)=O.C=CC(C)(O)CCC=C(C)CCC(=O)O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.59
FNTA P49354 7/20 0.37
FNTB P49356 7/20 0.37
HIF1A Q16665 1/20 0.34
EPAS1 Q99814 1/20 0.34
KMT2A Q03164 2/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
TRPA1 O75762 1/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34

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
Linalyl Acetate SCHEMBL5773882 0.89 ALOX15 (0.67) ALOX15HIF1AEPAS1KMT2AALDH1A1
SCHEMBL9017160 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL2004079 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL15914304 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL9017126 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL3506100 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL2004080 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL22372388 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL22372389 0.85 ALOX15 (0.59) ALOX15FNTAFNTBKMT2AALDH1A1
SCHEMBL8077797 0.84 ALOX15 (0.66) ALOX15FNTAFNTBKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7893014-B2 Using hydrophobic agent having melting point or glass transition temperature of less than 100 degrees C and zeta potential modifier so that composition has zeta potential that is positive and greater than zero millivolts, curing; may also include a fluoropolymer; kits GREGORY VAN BUSKIRK (US) 2011-02-22 US disclosed