SCHEMBL31365644

SCHEMBL31365644

CCCC(C)CC(C)CC(C)CC(C)CCCC(OCc1ccccc1)OC(CCCC(C)CC(C)CC(C)CC(C)CCC)OCc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.34
CTSK P43235 1/20 0.33
RCE1 Q9Y256 1/20 0.33
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 3/20 0.31
CSNK1E P49674 1/20 0.31
BCHE P06276 1/20 0.31

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
SCHEMBL31259341 0.90 CSNK1E (0.42) CETPCSNK1E
SCHEMBL31365545 0.89 HTT (0.34) HTTRCE1KMT2AMAPT
SCHEMBL31365624 0.88 HTT (0.33) HTTRCE1KMT2AMAPT
SCHEMBL31365655 0.88 HTT (0.33) HTTRCE1KMT2AMAPT
SCHEMBL31365474 0.88 HTT (0.33) HTTRCE1KMT2AMAPT
SCHEMBL31365660 0.88 HTT (0.33) HTTRCE1KMT2AMAPTBCHE
SCHEMBL31365542 0.88 HTT (0.33) HTTRCE1KMT2AMAPT
SCHEMBL31259239 0.84 HTT (0.34) HTTRCE1KMT2AMAPT
SCHEMBL31259257 0.84 HTT (0.40) HTTRCE1KMT2AMAPT
SCHEMBL31365575 0.77 TSHR (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119059889-A Haloalkylalkoxymethyl ether compound, process for producing 4,6,8,10,16-pentamethylbehene therefrom, and process for producing synthetic intermediate thereof 信越化学工业株式会社 2024-12-03 CN disclosed