Citronellol

Citronellol

SCHEMBL3372997

CC(C)=CCCC(C)CCO.CCO

nearest known ligand 0.91

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

MMP1MMP13MMP7MMP8polrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.91
ALDH1A1 P00352 1/20 0.91
USP2 O75604 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TSHR P16473 1/20 0.42
SQLE Q14534 3/20 0.38
NFE2L2 Q16236 1/20 0.37
GGPS1 O95749 2/20 0.36
FDPS P14324 2/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Citronellol SCHEMBL8758931 1.00 ALOX15 (0.91) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL18301310 0.96 ALOX15 (1.00) ALOX15ALDH1A1USP2TDP1TSHR
(+)-Citronellol SCHEMBL21321 0.96 ALOX15 (1.00) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL21320 0.96 ALOX15 (1.00) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL301394 0.96 ALOX15 (1.00) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL1871004 0.96 ALOX15 (1.00) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL11351853 0.93 ALOX15 (0.95) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL17688817 0.93 ALOX15 (0.95) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL30222407 0.93 ALOX15 (0.95) ALOX15ALDH1A1USP2TDP1TSHR
Citronellol SCHEMBL30843841 0.93 ALOX15 (0.95) ALOX15ALDH1A1USP2TDP1TSHR

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11324209-B2 Composition to promote migration of acarids ACAR'UP SPRL (BE) 2022-05-10 US disclosed
CN-108610236-B Method for improving selectivity of citronellal synthesized by hydrogenation 南京工业大学 2021-12-07 CN disclosed
US-20200390077-A1 Composition to Promote Migration of Acarids ACAR'UP SPRL (BE) 2020-12-17 US disclosed
EP-3716769-A1 COMPOSITION TO PROMOTE MIGRATION OF ACARIDS Acar'Up sprl (BE) 2020-10-07 EP disclosed
EP-3716770-A1 KIT AND METHOD USING A SYNERGISTIC COMPOSITION TO ATTRACT AND REMOVE ACARIDS Acar'Up sprl (BE) 2020-10-07 EP disclosed
EP-3116598-A1 DETERGENT COMPOSITION The Procter & Gamble Company (US) 2017-01-18 EP disclosed
WO-2015138576-A1 DETERGENT COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2015-09-17 WO disclosed
EP-0955994-B1 FRAGRANCE DELIVERY SYSTEMS FOR PERSONAL CARE ARTICLES PROCTER & GAMBLE (US) 2010-11-03 EP disclosed
US-6147037-A Fragrance delivery systems THE PROCTER & GAMBLE COMPANY (US) 2000-11-14 US disclosed
US-6126953-A BETA-KETOESTER PRO-ACCORDS, WHICH ARE CAPABLE OF RELEASING MIXTURES OF FRAGRANCE RAW MATERIALS. THE PROCTER & GAMBLE COMPANY (US) 2000-10-03 US disclosed
WO-1998017264-A1 COMPOSITION AND METHOD FOR TOPICAL TREATMENT OF ACTIVE HERPESVIRAL INFECTIONS NEXTECH ENTERPRISES INTERNATIONAL (US) 1998-04-30 WO disclosed
WO-1998017297-A1 METHOD FOR TOPICAL TREATMENT OF NONVIRAL EPITHELIAL DISORDERS CHIRALT CORPORATION (US) 1998-04-30 WO disclosed
WO-1998007405-A1 FRAGRANCE DELIVERY SYSTEMS THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO disclosed
WO-1998007407-A1 FRAGRANCE DELIVERY SYSTEMS FOR PERSONAL CARE ARTICLES THE PROCTER & GAMBLE COMPANY (US) 1998-02-26 WO disclosed
WO-1997034981-A1 DELIVERY SYSTEM HAVING RELEASE INHIBITOR LOADED ZEOLITE AND METHOD FOR MAKING SAME THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO disclosed
WO-1997034982-A1 DELIVERY SYSTEM HAVING RELEASE BARRIER LOADED ZEOLITE THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO disclosed
EP-0695166-A1 PERFUME COMPOSITION QUEST INTERNATIONAL NEDERLAND BV (NL) 1996-02-07 EP disclosed
WO-1994024999-A2 PERFUME COMPOSITION QUEST INTERNATIONAL B.V. (NL) 1994-11-10 WO disclosed
US-5139562-A Exposure to cineole, fenchone, menthol THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1992-08-18 US disclosed
WO-1992010934-A1 INHIBITION OF POTATO SPROUTING USING VOLATILE MONOTERPENES THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, UNITED STATES DEPARTMENT OF COMMERCE (US) 1992-07-09 WO disclosed