SCHEMBL3273714

SCHEMBL3273714

CC(C)=CCCC(C)CC=NO

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 4/20 0.53
ALDH1A1 P00352 2/20 0.53
TSHR P16473 1/20 0.40
USP2 O75604 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GGPS1 O95749 2/20 0.34
FDPS P14324 2/20 0.34
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
KMT2A Q03164 1/20 0.33
GLA P06280 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL15257175 1.00 ALOX15 (0.53) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL7884640 1.00 ALOX15 (0.53) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL28514934 0.86 ALOX15 (0.41) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL7884647 0.86 ALOX15 (0.61) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL28239729 0.83 ALOX15 (0.40) ALOX15ALDH1A1
SCHEMBL14252500 0.79 ALOX15 (0.48) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL3912321 0.77 ALOX15 (0.59) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL20871791 0.77 ALOX15 (0.46) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL8462432 0.75 ALOX15 (0.57) ALOX15ALDH1A1TSHRUSP2TDP1
SCHEMBL10544605 0.75 ALOX15 (0.63) ALOX15ALDH1A1TSHRUSP2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112358417-A Synthetic method of citronellal oxime 江苏宏邦化工科技有限公司 2021-02-12 CN claimed
CN-107677765-B Method for determining organic residue of hydroxylamine salt based on TOC (total organic carbon) derivatization catalytic combustion method 浙江圣安化工股份有限公司 2020-07-14 CN claimed
CN-107677765-A A kind of method for deriving Production by Catalytic Combustion Process measure hydroxylamine salt organic residue based on TOC 浙江圣安化工股份有限公司 2018-02-09 CN claimed
CN-104364387-B The method for producing terpene nitrile from terpene oxime using aldoxime dehydratase 巴斯夫欧洲公司 2017-12-19 CN claimed
EP-2825661-B1 PROCESS FOR PREPARING TERPENE NITRILES FROM TERPENE OXIMES EMPLOYING AN ALDOXIME DEHYDRATASE BASF SE (DE) 2016-05-18 EP claimed
US-9080191-B2 Method for biocatalytic production of nitriles from oximes and oxime dehydratases usable therein BASF SE (DE) 2015-07-14 US claimed
CN-104364387-A Method for producing terpene nitriles from terpene oximes using an aldoxime dehydratase BASF SE 2015-02-18 CN claimed
US-20130244298-A1 METHOD FOR BIOCATALYTIC PRODUCTION OF NITRILES FROM OXIMES AND OXIME DEHYDRATASES USABLE THEREIN BASF SE (DE) 2013-09-19 US claimed
CN-116178209-B Preparation method of citronellyl nitrile 鹰潭华煜生物科技有限公司 2025-03-25 CN disclosed
CN-116178210-B Preparation method of citronellyl nitrile derivative 鹰潭华煜生物科技有限公司 2023-10-13 CN disclosed
CN-116178209-A Preparation method of citronellyl nitrile 鹰潭华煜生物科技有限公司 2023-05-30 CN disclosed
CN-116178210-A Preparation method of citronellyl nitrile derivative 鹰潭华煜生物科技有限公司 2023-05-30 CN disclosed
CN-111848448-B Preparation method of citronellonitrile 万华化学集团股份有限公司 2022-07-12 CN disclosed
CN-113683532-B Preparation method of citronellonitrile and catalyst adopted by same 山东新和成药业有限公司 2022-01-18 CN disclosed
US-4847292-A Repelling animals with compositions comprising citronellyl nitrile, citronellol, alpha-terpinyl methyl ether and lemon oil INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1989-07-11 US disclosed
US-4456562-A AZEOTROPIC DISTILLATION OF WATER FROM REACTION PRODUCT OF ANALDEHYDE AND HYDROXYLAMINE OR ALDOXIME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-06-26 US disclosed
EP-0080700-A1 A process for producing nitrile compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-06-08 EP disclosed
US-3982014-A Arthropod maturation inhibitors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-09-21 US disclosed
US-3978230-A INSECTICIDES, TERPENOIDS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-08-31 US disclosed
US-3933865-A Arthropod maturation inhibitors THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1976-01-20 US disclosed