Dimethylcarbate

Dimethylcarbate

SCHEMBL9680337

CN(C)C(=O)O.Oc1cnccc1/N=C/N1CCOCC1

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
HTT P42858 1/20 0.36
POLB P06746 4/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
TSHR P16473 2/20 0.34
HSD17B10 Q99714 2/20 0.34
USP2 O75604 2/20 0.34
RPS6KA3 P51812 1/20 0.33
RPS6KA2 Q15349 1/20 0.33
RPS6KA1 Q15418 1/20 0.33
HIF1A Q16665 1/20 0.33
LMNA P02545 2/20 0.33
RAB9A P51151 3/20 0.32
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
CCNC P24863 1/20 0.32
CDK8 P49336 1/20 0.32
NPC1 O15118 2/20 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
Dimethylcarbate SCHEMBL9680345 1.00 GAA (0.40) GAAHTTPOLBMEN1KMT2A
Dimethylcarbate SCHEMBL9679881 0.90 POLB (0.33) HTTPOLBTSHRLMNAALDH1A1
Dimethylcarbate SCHEMBL9679888 0.90 POLB (0.33) HTTPOLBTSHRLMNAALDH1A1
Dimethylcarbate SCHEMBL9679403 0.89 HTT (0.34) HTTPOLBTSHRLMNAALDH1A1
Dimethylcarbate SCHEMBL9681075 0.89 HTT (0.34) HTTPOLBTSHRLMNAALDH1A1
Dimethylcarbate SCHEMBL9679397 0.89 HTT (0.34) HTTPOLBTSHRLMNAALDH1A1
Dimethylcarbate SCHEMBL9681079 0.89 HTT (0.34) HTTPOLBTSHRLMNAALDH1A1
SCHEMBL9017897 0.89 GAA (0.42) GAAHTTPOLBMEN1KMT2A
SCHEMBL9017894 0.89 GAA (0.42) GAAHTTPOLBMEN1KMT2A
Dimethylcarbate SCHEMBL9680307 0.87 KDM4E (0.30) ALDH1A1MAPT

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
EP-0477903-A2 Substituted-4-amino-3-pyridinols, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1992-04-01 EP disclosed