Geraniol

Geraniol

SCHEMBL16346237

C=CCO.CC(C)=CCC/C(C)=C/CO

nearest known ligand 0.83

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Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.83
ALOX15 P16050 3/20 0.83
MEN1 O00255 2/20 0.83
CYP3A4 P08684 2/20 0.83
MAPT P10636 2/20 0.79
ALDH1A1 P00352 2/20 0.79
UGT1A1 P22309 1/20 0.79
SQLE Q14534 6/20 0.57
KDM4E B2RXH2 1/20 0.48
TSHR P16473 1/20 0.48
ICMT O60725 1/20 0.47

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
Geraniol SCHEMBL16346238 1.00 KMT2A (0.83) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL9051249 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Nerol SCHEMBL3319949 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL11280775 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL19824 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL8676054 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL2874022 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL118988 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL21173796 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT
Geraniol SCHEMBL30529087 0.91 KMT2A (1.00) KMT2AALOX15MEN1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109996865-B Formation of alkenes by enzymatic dehydration of alkanols 布拉斯肯有限公司 2023-02-03 CN disclosed
EP-3017051-B1 METHOD FOR THE ENZYMATIC PRODUCTION OF 3-BUTEN-2-ONE SCIENTIST OF FORTUNE SA (LU) 2021-06-30 EP disclosed
CN-109996865-A It is dehydrated to form alkene by the enzymatic of alkanol 布拉斯肯有限公司 2019-07-09 CN disclosed
US-9850504-B2 Method for the enzymatic production of 3-buten-2-one Scientist of Fortune, S.A. (LU) 2017-12-26 US disclosed
US-20160369306-A1 METHOD FOR THE ENZYMATIC PRODUCTION OF 3-BUTEN-2-ONE GLOBAL BIOENERGIES (FR) 2016-12-22 US disclosed
EP-3017051-A2 METHOD FOR THE ENZYMATIC PRODUCTION OF 3-BUTEN-2-ONE Scientist of Fortune S.A. (LU) 2016-05-11 EP disclosed
CN-105209615-A Alkenol dehydratase variants GLOBAL BIOENERGIES 2015-12-30 CN disclosed
CN-104736713-A Production of volatile dienes by enzymatic dehydration of light alkenols SCIENTIST OF FORTUNE SA 2015-06-24 CN disclosed
WO-2015000981-A2 METHOD FOR THE ENZYMATIC PRODUCTION OF 3-BUTEN-2-ONE SCIENTIST OF FORTUNE S.A. (LU) 2015-01-08 WO disclosed