Geranyl Acetate

Geranyl Acetate

SCHEMBL16756649

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

nearest known ligand 0.93

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Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Geranyl Acetate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.93
ALOX15 P16050 1/20 0.93
FNTA P49354 3/20 0.58
FNTB P49356 3/20 0.58
TRPV1 Q8NER1 2/20 0.56
PGGT1B P53609 1/20 0.55
KDM4E B2RXH2 1/20 0.53
ATM Q13315 1/20 0.53
KMT2A Q03164 1/20 0.52

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
Neryl Acetate SCHEMBL5306553 1.00 ALDH1A1 (0.93) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL901162 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL236190 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL56913 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL1869319 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Neryl Acetate SCHEMBL1865830 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL56914 0.96 ALDH1A1 (1.00) ALDH1A1ALOX15FNTAFNTBTRPV1
Geranyl Acetate SCHEMBL28213313 0.95 ALDH1A1 (0.89) ALDH1A1ALOX15FNTAFNTBTRPV1
SCHEMBL11404530 0.94 ALDH1A1 (0.96) ALDH1A1ALOX15FNTAFNTBTRPV1
SCHEMBL11404533 0.94 ALDH1A1 (0.96) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210253985-A1 MOSCATO WINE REPLICAS PRODUCED FROM INDIVIDUAL COMPONENTS AVA FOOD LABS, INC. 2021-08-19 US disclosed
US-20210198603-A1 ALCOHOLIC BEVERAGES PRODUCED FROM INDIVIDUAL COMPONENTS AVA FOOD LABS, INC. 2021-07-01 US disclosed
US-20200094003-A1 MULTI-USE CARTRIDGE FOR INGESTION OF CANNABIS-BASED PRODUCTS CMG PARTNERS, INC. 2020-03-26 US disclosed
EP-3326659-B1 AN ABSORBENT ARTICLE COMPRISING AN ODOR CONTROL MIXTURE TOILETRY SALES LTD (GB) 2019-11-13 EP disclosed
EP-3326659-A1 AN ABSORBENT ARTICLE COMPRISING AN ODOR CONTROL MIXTURE Toiletry Sales Limited (GB) 2018-05-30 EP disclosed
US-20150150922-A1 COMPOSITION FOR USE IN AROMATHERAPY, AROMA MEDICINE AND AROMATOLOGY HEFTI DORIS (CH) 2015-06-04 US disclosed
CN-101760305-A Rose essence for lipstick XIAOMING WANG 2010-06-30 CN disclosed