Geranyl Acetate

Geranyl Acetate

SCHEMBL28213313

CC(=O)OC/C=C(\C)CCC=C(C)C.c1ccccc1

nearest known ligand 0.89

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Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.89
ALOX15 P16050 1/20 0.89
TRPV1 Q8NER1 2/20 0.62
FNTA P49354 2/20 0.57
FNTB P49356 2/20 0.57
PGGT1B P53609 1/20 0.54

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 SCHEMBL16756649 0.95 ALDH1A1 (0.93) ALDH1A1ALOX15TRPV1FNTAFNTB
Neryl Acetate SCHEMBL5306553 0.95 ALDH1A1 (0.93) ALDH1A1ALOX15TRPV1FNTAFNTB
Neryl Acetate SCHEMBL1865830 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
Neryl Acetate SCHEMBL236190 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
Geranyl Acetate SCHEMBL56913 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
Geranyl Acetate SCHEMBL56914 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
Geranyl Acetate SCHEMBL1869319 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
Geranyl Acetate SCHEMBL901162 0.94 ALDH1A1 (1.00) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL11404533 0.93 ALDH1A1 (0.96) ALDH1A1ALOX15TRPV1FNTAFNTB
SCHEMBL806928 0.93 ALDH1A1 (0.96) ALDH1A1ALOX15TRPV1FNTAFNTB

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
CN-108004055-A Fragrant detergent and preparation method thereof 上海和玉无纺布制品厂 2018-05-08 CN disclosed