SCHEMBL20862115

SCHEMBL20862115

CCOCCOC(=O)CON

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
TSHR P16473 2/20 0.54
THRB P10828 2/20 0.47
HSD17B10 Q99714 2/20 0.39
DGKA P23743 1/20 0.36
CTH P32929 1/20 0.36
CBS P35520 1/20 0.36
THPO P40225 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
ALOX15 P16050 1/20 0.34
MGAM O43451 1/20 0.34
GAA P10253 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
EPHX2 P34913 1/20 0.34
NAAA Q02083 1/20 0.32
CYP1A2 P05177 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
SCHEMBL780053 0.85 ALDH1A1 (0.60) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL17974553 0.83 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL9888985 0.81 ALDH1A1 (0.56) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL3895686 0.80
SCHEMBL439088 0.80
SCHEMBL18470076 0.79 ALDH1A1 (0.54) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL16114892 0.79 ALDH1A1 (0.72) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL20862160 0.78 TSHR (0.39) ALDH1A1TSHRTHRBDGKACTH
SCHEMBL14926861 0.78 ALDH1A1 (0.58) ALDH1A1TSHRTHRBHSD17B10DGKA
SCHEMBL1301905 0.78 ALDH1A1 (0.62) ALDH1A1TSHRTHRBHSD17B10DGKA

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-3692102-B1 HIGH WET FAST DISPERSE DYE MIXTURES DYSTAR COLOURS DISTRIB GMBH (DE) 2021-11-10 EP disclosed
EP-3461861-B1 HIGH WET FAST DISPERSE DYE MIXTURES DYSTAR COLOURS DISTRIB GMBH (DE) 2020-07-15 EP disclosed
WO-2019068443-A1 HIGH WET FAST DISPERSE DYE MIXTURES DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2019-04-11 WO disclosed
EP-3461861-A1 HIGH WET FAST DISPERSE DYE MIXTURES DyStar Colours Distribution GmbH (DE) 2019-04-03 EP disclosed