Acetamide

Acetamide

SCHEMBL11255947

CC(N)=O.CCCCCS(=O)(=O)O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.50
APP P05067 1/20 0.46
CA2 P00918 6/20 0.43
FAAH O00519 5/20 0.43
TP53 P04637 1/20 0.42
CES2 O00748 3/20 0.40
CES1 P23141 2/20 0.40
S1PR2 O95136 1/20 0.39
S1PR1 P21453 1/20 0.39
S1PR3 Q99500 1/20 0.39
LMNA P02545 1/20 0.39
SLC6A6 P31641 1/20 0.39
CYP2C19 P33261 1/20 0.39
BLM P54132 1/20 0.39

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
Urea SCHEMBL27624998 0.89 EPHX2 (0.49) EPHX2APPCA2FAAHTP53
Acetic Acid SCHEMBL11049476 0.88 EPHX2 (0.51) EPHX2APPFAAHCES2CES1
Acetone SCHEMBL27900517 0.88 EPHX2 (0.56) EPHX2APPCA2FAAHCES2
Hydrazine SCHEMBL27737879 0.88 APP (0.52) EPHX2APPCA2FAAHTP53
Methylamine SCHEMBL3807889 0.88 APP (0.52) EPHX2APPCA2FAAHTP53
SCHEMBL11336 0.88
SCHEMBL2099691 0.88 TDP1 (0.46) EPHX2APPCA2FAAHTP53
Acetic Acid SCHEMBL29064775 0.86 EPHX2 (0.54) EPHX2APPFAAHCES2
SCHEMBL2103322 0.86 EPHX2 (0.47) EPHX2APPCA2FAAHCES2
Bicarbonate SCHEMBL28303753 0.86 EPHX2 (0.53) EPHX2APPFAAHCES2CES1

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-0095177-A1 Process for the preparation of N-acetylamino-aryl-sulphonic acids HOECHST AKTIENGESELLSCHAFT (DE) 1983-11-30 EP disclosed