SCHEMBL11228277

SCHEMBL11228277

C=CC(=O)NC(=O)OCC.N=C=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.35
GAA P10253 3/20 0.35
MGAM O43451 1/20 0.34
SI P14410 1/20 0.34
MGAM2 Q2M2H8 1/20 0.34
TSHR P16473 4/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
MEN1 O00255 1/20 0.33
PSMD14 O00487 1/20 0.33
KMT2A Q03164 1/20 0.33
PSMB11 A5LHX3 1/20 0.32
PSMA7 O14818 1/20 0.32
PSMB1 P20618 1/20 0.32
PSMA1 P25786 1/20 0.32
PSMA2 P25787 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
SCHEMBL93928 0.91 GAA (0.41) ALDH1A1L3MBTL1POLBGAAMGAM
SCHEMBL8755750 0.89 GAA (0.39) ALDH1A1L3MBTL1POLBGAAMGAM
SCHEMBL27963209 0.89 GAA (0.39) ALDH1A1L3MBTL1POLBGAAMGAM
SCHEMBL15519414 0.84 GAA (0.35) ALDH1A1L3MBTL1POLBGAAMGAM
SCHEMBL27977223 0.77 TSHR (0.38) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL22932209 0.76 GAA (0.38) ALDH1A1L3MBTL1POLBGAAMGAM
SCHEMBL2932133 0.76 TSHR (0.42) ALDH1A1TSHRMAPK1TDP1ZDHHC20
Acrylic Acid Ethyl Ester SCHEMBL19284484 0.75 TSHR (0.50) ALDH1A1GAAMGAMSIMGAM2
Acrylic Acid Ethyl Ester SCHEMBL28975628 0.75 TSHR (0.50) ALDH1A1GAAMGAMSIMGAM2
Acrylic Acid Ethyl Ester SCHEMBL1968900 0.75 TSHR (0.50) ALDH1A1GAAMGAMSIMGAM2

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
US-4330657-A Process for the production of storage-stable urethane acryls CHEMISCHE WERKE HULS AKTIENGESELLSCHAFT (DE) 1982-05-18 US disclosed