SCHEMBL28083015

SCHEMBL28083015

C=CC(=O)NOC(=O)CC(=O)OC.[NaH]

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
TSHR P16473 5/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 2/20 0.36
HSD17B10 Q99714 2/20 0.33
TGM2 P21980 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
KDM4E B2RXH2 1/20 0.31
PSMB11 A5LHX3 1/20 0.31
PSMA7 O14818 1/20 0.31
PSMB1 P20618 1/20 0.31
PSMA1 P25786 1/20 0.31
PSMA2 P25787 1/20 0.31
PSMA3 P25788 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
SCHEMBL28082944 0.96 MGAM (0.38) MGAMGAASIMGAM2TSHR
Ammonia Solution, Strong SCHEMBL28082510 0.96 MGAM (0.38) MGAMGAASIMGAM2TSHR
SCHEMBL13275793 0.82 MGAM (0.44) MGAMGAASIMGAM2TSHR
Methoxymethane SCHEMBL10590346 0.80 TSHR (0.37) TSHRALDH1A1MAPK1TDP1LMNA
SCHEMBL10590343 0.80 TSHR (0.37) TSHRALDH1A1MAPK1TDP1LMNA
SCHEMBL836331 0.79 ALDH1A1 (0.44) MGAMGAASIMGAM2TSHR
SCHEMBL18139168 0.79 TSHR (0.39) TSHRALDH1A1MAPK1TDP1LMNA
Ammonia Solution, Strong SCHEMBL28190594 0.78 TSHR (0.38) TSHRALDH1A1MAPK1TDP1LMNA
SCHEMBL11135735 0.77 TSHR (0.41) TSHRALDH1A1MAPK1TDP1ZDHHC20
SCHEMBL28217419 0.77 TSHR (0.41) TSHRALDH1A1MAPK1TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-107430213-A Hydrophilic optical feature monofilm and its layered product 三井化学株式会社 2017-12-01 CN disclosed
CN-105814092-A Composition for hydrophilic cured product 三井化学株式会社 2016-07-27 CN disclosed