Acetamide

Acetamide

SCHEMBL7021945

CC(N)=O.Nc1ccc[nH]c1=O

nearest known ligand 0.76

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.76
AURKB Q96GD4 2/20 0.76
INCENP Q9NQS7 2/20 0.76
NAPRT Q6XQN6 1/20 0.47
DAO P14920 1/20 0.47
PARP1 P09874 1/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
JAK2 O60674 1/20 0.43
RPS6KA3 P51812 1/20 0.43
MELK Q14680 1/20 0.43
STK24 Q9Y6E0 1/20 0.43
TYK2 P29597 1/20 0.41
MAPT P10636 4/20 0.39
KDM4E B2RXH2 3/20 0.39
GAA P10253 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
BLM P54132 2/20 0.39
KMT2A Q03164 2/20 0.39
THRB P10828 2/20 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
SCHEMBL87697 0.87
Hydrochloric Acid SCHEMBL4056092 0.85
Sulfamide SCHEMBL27834517 0.79 AURKA (0.83) AURKAAURKBINCENPNAPRTDAO
Formamide SCHEMBL17503641 0.79 AURKA (0.83) AURKAAURKBINCENPNAPRTDAO
SCHEMBL7642912 0.76 AURKA (0.76) AURKAAURKBINCENPNAPRTDAO
Anthranilamide SCHEMBL5170575 0.74 AURKA (0.55) AURKAAURKBINCENPNAPRTDAO
SCHEMBL3182033 0.71 NAPRT (0.67) AURKAAURKBINCENPNAPRTDAO
SCHEMBL82637 0.71 NAPRT (0.67) AURKAAURKBINCENPNAPRTDAO
Acetamide SCHEMBL7526547 0.71 FKBP5 (0.70) AURKAAURKBINCENPNAPRTDAO
SCHEMBL3831213 0.71 AURKA (0.66) AURKAAURKBINCENPDAOPARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0997474-B1 Antithrombotic agents PFIZER (US) 2003-10-29 EP disclosed
US-6417203-B1 HETEROCYCLIC AMIDES PFIZER INC. 2002-07-09 US disclosed
US-6180627-B1 INDOLE, INDAZOLE, BENZOTRIAZOLE AND BENZIMIDAZOLE DERIVATIVES PFIZER INC. 2001-01-30 US disclosed
EP-0997474-A1 Antithrombotic agents PFIZER INC. (US) 2000-05-03 EP disclosed