SCHEMBL16615910

SCHEMBL16615910

CCCOCCCCOC(C)CC

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
HSD17B10 Q99714 1/20 0.38
HTT P42858 2/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
USP2 O75604 1/20 0.35
TSHR P16473 2/20 0.34
DNM1 Q05193 1/20 0.33
LPAR1 Q92633 4/20 0.33
LPAR3 Q9UBY5 4/20 0.33
LPAR2 Q9HBW0 1/20 0.33
SPHK1 Q9NYA1 1/20 0.32
CYP3A4 P08684 1/20 0.30
SPHK2 Q9NRA0 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
SCHEMBL13380879 0.86 TDP1 (0.43) TDP1HSD17B10
SCHEMBL4830601 0.86 TDP1 (0.43) TDP1HSD17B10
SCHEMBL16615645 0.85 DNM1 (0.36) TDP1TSHRDNM1
SCHEMBL16615781 0.85 DNM1 (0.36) TDP1TSHRDNM1
SCHEMBL27905294 0.84 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL4839751 0.84 HTT (0.48) HTTMEN1THRBKMT2AMAPT
SCHEMBL16615911 0.84 ALDH1A1 (0.35) TSHRDNM1LPAR1LPAR3LPAR2
SCHEMBL8400590 0.83 DNM1 (0.46) HTTMEN1THRBKMT2AMAPT
SCHEMBL28774505 0.83 HTT (0.52) TDP1HTTMEN1THRBKMT2A
SCHEMBL289283 0.82 TSHR (0.44) TDP1HSD17B10HTTMEN1THRB

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
WO-2015046313-A1 SOLID ELECTROLYTE COMPOSITION, BINDER FOR ALL-SOLID-STATE SECONDARY BATTERIES, AND ELECTRODE SHEET FOR BATTERIES AND ALL-SOLID-STATE SECONDARY BATTERY EACH USING SAID SOLID ELECTROLYTE COMPOSITION 富士フイルム株式会社 2015-04-02 WO disclosed