SCHEMBL28112306

SCHEMBL28112306

CC(COCCOCCO)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
ALDH1A1 P00352 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 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
Di(Hydroxyethyl)Ether SCHEMBL4840284 0.82 TSHR (0.42) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL17927977 0.82 TDP1 (0.47) TDP1HSD17B10
SCHEMBL17927984 0.81 TDP1 (0.32) MAPK1TDP1
SCHEMBL3421310 0.80 MEN1 (0.44) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL17927982 0.79 TDP1 (0.35) TSHRALDH1A1TDP1HSD17B10
SCHEMBL31414737 0.79 TDP1 (0.31) TDP1
SCHEMBL27625710 0.79 MAPK1 (0.38) MAPK1TDP1
SCHEMBL2332721 0.79 MEN1 (0.52) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL4838627 0.79 TSHR (0.48) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL18327246 0.78 GABRP (0.31) MEN1KMT2ATDP1

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
CN-112481004-A Boric acid ester type automobile brake fluid 安徽天驰先锋油品制造有限公司 2021-03-12 CN disclosed
CN-106190450-B A kind of alcohol ether borate type braking fluid 辽宁道博精细化学品生产有限公司 2019-07-16 CN disclosed
CN-106190450-A A kind of alcohol ether borate type braking fluid 辽宁道博精细化学品生产有限公司 2016-12-07 CN disclosed
CN-106190451-A A kind of preparation method of alcohol ether borate type braking fluid 辽宁道博精细化学品生产有限公司 2016-12-07 CN disclosed