SCHEMBL2123382

SCHEMBL2123382

CC(=COCCOCCOCCOCCOCCOCCO)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
TSHR P16473 2/20 0.39
MAPK1 P28482 1/20 0.39
THRB P10828 1/20 0.35
HTT P42858 1/20 0.35
MAPT P10636 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL715215 1.00 MEN1 (0.42) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL714155 1.00 MEN1 (0.42) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL502736 1.00 MEN1 (0.42) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL29196435 0.92 ALDH1A1 (0.32) TSHRALDH1A1
SCHEMBL10985217 0.88 TSHR (0.32) TSHR
SCHEMBL170593 0.88 TSHR (0.32) TSHR
Di(Hydroxyethyl)Ether SCHEMBL28477685 0.87 ALDH1A1 (0.41) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL28506569 0.85 PTGS1 (0.33)
SCHEMBL1325112 0.85 TSHR (0.33) MEN1KMT2ATSHRMAPK1ALDH1A1
SCHEMBL2878687 0.85 ALDH1A1 (0.31) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3345939-B1 POWDER MIXTURE DAINIPPON INK & CHEMICALS (JP) 2020-10-14 EP disclosed
US-9905855-B2 Binder composition for non-aqueous secondary battery electrode TOYO INK SC HOLDINGS CO., LTD. (JP) 2018-02-27 US disclosed
US-20160156039-A1 BINDER COMPOSITION FOR NON-AQUEOUS SECONDARY BATTERY ELECTRODE TOYO INK SC HOLDINGS CO., LTD. (JP) 2016-06-02 US disclosed
US-20120095131-A1 BINDER COMPOSITION FOR NON-AQUEOUS SECONDARY BATTERY ELECTRODE TOYOCHEM CO., LTD. (JP) 2012-04-19 US disclosed