Dimethylcarbate

Dimethylcarbate

SCHEMBL10504107

CN(C)C(=O)C1=CC(=O)CCC1.CN(C)C(=O)O

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MT-CO2 P00403 2/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 2/20 0.32
ALOX5 P09917 1/20 0.30
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
Trimethylammonium SCHEMBL28000537 0.79 MT-CO2 (0.37) MT-CO2MAPTALDH1A1RXRARXRB
SCHEMBL2082622 0.74 OAT (0.41) MT-CO2MAPTALDH1A1
SCHEMBL2081539 0.72 MT-CO2 (0.40) MT-CO2MAPTALDH1A1
SCHEMBL17472510 0.71 HDAC2 (0.50) ALDH1A1
SCHEMBL2600393 0.69 CHRM3 (0.42) MAPTALDH1A1
SCHEMBL28357833 0.69 HDAC2 (0.52) ALDH1A1
SCHEMBL11567183 0.68
SCHEMBL25408481 0.67 MAPT (0.38) MT-CO2MAPTALDH1A1
SCHEMBL31259192 0.67 MAPT (0.38) MT-CO2MAPTALDH1A1
Dimethylcarbate SCHEMBL10506407 0.66 TRIM24 (0.35) ALDH1A1

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
EP-0156773-B1 DERIVATIVES OF CYCLOHEXENONE CARBOXYLICACID WITH HERBICIDE ACTION AND THE ABILITY TO REGULATE THE GROWTH OF PLANTS CIBA-GEIGY AG (CH) 1989-09-06 EP disclosed
EP-0156773-A2 Derivatives of cyclohexenone carboxylicacid with herbicide action and the ability to regulate the growth of plants CIBA-GEIGY AG (CH) 1985-10-02 EP disclosed
EP-0126713-A2 Cyclohexanedione-carboxylic-acid derivatives having a herbicidal and plant growth regulating activity CIBA-GEIGY AG (CH) 1984-11-28 EP disclosed