Ethoxycarbonyl Group

Ethoxycarbonyl Group

SCHEMBL4201314

CCOC=O.CCSC#N

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
TP53 P04637 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 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
Ethoxycarbonyl Group SCHEMBL3767822 0.78
Ethoxycarbonyl Group SCHEMBL30999673 0.77
Ethoxycarbonyl Group SCHEMBL28029878 0.75
Water SCHEMBL27581439 0.75 ALDH1A1 (0.50) ALDH1A1TP53HPGDTSHRMAPK1
Ethoxycarbonyl Group SCHEMBL5306888 0.75 ALDH1A1 (0.38) ALDH1A1TSHRMAPK1TDP1
Ethoxycarbonyl Group SCHEMBL1332384 0.75
SCHEMBL767312 0.75
Ethoxycarbonyl Group SCHEMBL453 0.75
Ethoxycarbonyl Group SCHEMBL1653351 0.72
Ethoxycarbonyl Group SCHEMBL374751 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8278352-B2 Pesticide compositions and methods COMMONWEALTH SCIENTIFIC & INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-10-02 US disclosed
US-20090012158-A1 Pesticide Compositions and Methods COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2009-01-08 US disclosed