SCHEMBL27613409

SCHEMBL27613409

CC=CCCC(C)(C)CC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL23987116 0.87
SCHEMBL55857 0.82
SCHEMBL8960861 0.79
SCHEMBL30891556 0.79
SCHEMBL8960855 0.79
SCHEMBL4602448 0.79
SCHEMBL2282242 0.79
SCHEMBL6059552 0.78
SCHEMBL29210930 0.78
SCHEMBL7989278 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110386863-A The method for being prepared with the reduced form halide that carbon-to-carbon unsaturated bond is reduced 信越化学工业株式会社 2019-10-29 CN disclosed
CN-101641431-B Fragrance compositions and compounds QUEST INT SERV BV 2013-02-20 CN disclosed
CN-101901933-A Nonaqueous electrolytic solution, positive pole and rechargeable nonaqueous electrolytic battery SONY CORP 2010-12-01 CN disclosed
CN-101641431-A Flavor compositions and compound QUEST INT SERV BV NL 2010-02-03 CN disclosed
CN-1902182-A Macrocyclic lactams and pharmaceutical use thereof NOVARTIS AG (CH) 2007-01-24 CN disclosed
CN-1674884-A Synergistic combination of an alpha-2-delta ligand and a PDEV inhibitor for use in the treatment of pain PFIZER LTD (US) 2005-09-28 CN disclosed