SCHEMBL6656799

SCHEMBL6656799

CC(=O)/C(C)=C/CC(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KISS1R Q969F8 2/20 0.31
TRPA1 O75762 1/20 0.30
TSHR P16473 1/20 0.30
THPO P40225 1/20 0.30

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
SCHEMBL6656802 1.00 GRIK1 (0.39) GRIK1ALDH1A1TDP1KISS1RTRPA1
SCHEMBL18290946 0.84 GRIK1 (0.39) GRIK1ALDH1A1TDP1TRPA1
SCHEMBL23252 0.82 GRIK1 (0.47) GRIK1ALDH1A1TDP1
SCHEMBL4056552 0.82 TDP1 (0.31) ALDH1A1TDP1TSHR
SCHEMBL23250 0.82 GRIK1 (0.47) GRIK1ALDH1A1TDP1
SCHEMBL3232685 0.80 GRIK1 (0.41) GRIK1ALDH1A1TDP1
SCHEMBL630861 0.80 GRIK1 (0.41) GRIK1ALDH1A1TDP1
Hydrochloric Acid SCHEMBL38657492 0.80 GRIK1 (0.46) GRIK1ALDH1A1TDP1
SCHEMBL18117661 0.80 GRIK1 (0.37) GRIK1ALDH1A1TDP1
SCHEMBL9512843 0.80 GRIK1 (0.37) GRIK1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026100325-A1 ORGANIC COMPOUND PRODUCTION DEVICE AND ORGANIC COMPOUND PRODUCTION METHOD 花王株式会社 2026-05-15 WO disclosed
CN-108349859-B Cyclopropane compounds 花王株式会社 2022-01-11 CN disclosed
EP-3375770-B1 CYCLOPROPANE COMPOUND KAO CORP (JP) 2020-06-03 EP disclosed
EP-3279300-B1 FRAGRANCE COMPOSITION KAO CORP (JP) 2019-03-27 EP disclosed
US-20190055179-A1 CYCLOPROPANE COMPOUND KAO CORPORATION (JP) 2019-02-21 US disclosed
EP-3375770-A1 CYCLOPROPANE COMPOUND Kao Corporation (JP) 2018-09-19 EP disclosed
EP-3279300-A1 FRAGRANCE COMPOSITION KAO CORPORATION (JP) 2018-02-07 EP disclosed
EP-2857482-B1 PERFUME COMPOSITION KAO CORP (JP) 2017-10-11 EP disclosed
EP-2857482-B1 PERFUME COMPOSITION KAO CORP (JP) 2017-10-11 EP disclosed
US-9567550-B2 Fragrance composition KAO CORPORATION (JP) 2017-02-14 US disclosed
CN-104334701-A Perfume composition KAO CORP 2015-02-04 CN disclosed
US-20130065969-A9 Odour Compounds GIVAUDAN SA (CH) 2013-03-14 US disclosed
US-20120184630-A1 Odour Compounds KRAFT PHILIP (CH) 2012-07-19 US disclosed
EP-2475639-A2 ODOUR COMPOUNDS Givaudan SA (CH) 2012-07-18 EP disclosed
WO-2011029895-A2 ODOUR COMPOUNDS GIVAUDAN SA (CH) 2011-03-17 WO disclosed
US-20040249218-A1 Method for producing 6-methylheptane-2-one and the use thereof OXENO OLEFINCHEMIE GMBH (DE) 2004-12-09 US disclosed
EP-1440051-A1 METHOD FOR PRODUCING 6-METHYLHEPTANE-2-ONE AND THE USE THEREOF Oxeno Olefinchemie GmbH (DE) 2004-07-28 EP disclosed
WO-2003031383-A1 METHOD FOR PRODUCING 6-METHYLHEPTANE-2-ONE AND THE USE THEREOF OXENO OLEFINCHEMIE GMBH (DE) 2003-04-17 WO disclosed
US-4156690-A REACTING A KETONE AND A NITRILE, BASIC CATALYST POLAK'S FRUTAL WORKS, INC. (US) 1979-05-29 US disclosed
US-4005147-A Production of α,β-unsaturated ketones BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) 1977-01-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190055179-A1 CYCLOPROPANE COMPOUND CNR1, TRPA1, TRPV1 GRIK1 2976/4885ALDH1A1 1083/4885TDP1 4132/4885
US-20130065969-A9 Odour Compounds PRMT9, PRMT5, PRMT1 GRIK1 1164/4885ALDH1A1 2749/4885TDP1 4605/4885
US-20040249218-A1 Method for producing 6-methylheptane-2-one and the use thereof DHPS, ADH1C, DOHH GRIK1 1849/4885ALDH1A1 585/4885TDP1 1853/4885
US-20120184630-A1 Odour Compounds PRMT9, PRMT5, PRMT1 GRIK1 1164/4885ALDH1A1 2749/4885TDP1 4605/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.