Geranyl Acetate

Geranyl Acetate

SCHEMBL7073230

CC(=O)OC/C=C(\C)CCC=C(C)C.CCCCCCOC(C)=O

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.71
ALOX15 P16050 1/20 0.71
LSS P48449 1/20 0.48
FNTA P49354 2/20 0.46
FNTB P49356 2/20 0.46
TRPV1 Q8NER1 2/20 0.46
PGGT1B P53609 1/20 0.46
PTPN1 P18031 1/20 0.43

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
Geranyl Acetate SCHEMBL7073233 1.00 ALDH1A1 (0.71) ALDH1A1ALOX15LSSFNTAFNTB
Benzoic Acid Hexyl Ester SCHEMBL8071129 0.85 TRPV1 (0.56) ALDH1A1ALOX15TRPV1
Benzoic Acid Hexyl Ester SCHEMBL8071130 0.85 TRPV1 (0.56) ALDH1A1ALOX15TRPV1
Geranyl Acetate SCHEMBL56913 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL236190 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL56914 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
SCHEMBL17251248 0.84 ALDH1A1 (0.56) ALDH1A1ALOX15LSSFNTAFNTB
Geranyl Acetate SCHEMBL1869319 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL901162 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL1865830 0.84 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1

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-20030031588-A1 Device for enriching air with an air treatment agent, especially for the disinfection of air, and/or perfuming of air and/or for odor masking SCHUR JORG PETER (DE) 2003-02-13 US disclosed