Acetamide

Acetamide

SCHEMBL6972197

CC(C)c1nc(CO)n(Cc2ccccc2)c1Sc1cc(Cl)cc(Cl)c1.CC(N)=O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.34
RECQL P46063 1/20 0.34
LMNA P02545 2/20 0.34
TLR7 Q9NYK1 1/20 0.34
KCNJ6 P48051 1/20 0.34
KCNJ5 P48544 1/20 0.34
KCNJ3 P48549 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
P2RX3 P56373 1/20 0.33
KDM4E B2RXH2 1/20 0.33
FABP3 P05413 1/20 0.33
FABP4 P15090 1/20 0.33
FABP5 Q01469 1/20 0.33

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
SCHEMBL6966848 0.94 TDP1 (0.42) TDP1MEN1KMT2AALDH1A1RECQL
Carbamic Acid SCHEMBL667612 0.89 PIM1 (0.36) TDP1MEN1KMT2AP2RX3
Acetamide SCHEMBL6959979 0.89 TDP1 (0.38) TDP1MEN1KMT2AALDH1A1RECQL
SCHEMBL6967638 0.86 TDP1 (0.39) TDP1MEN1KMT2AALDH1A1RECQL
SCHEMBL6966952 0.86 TDP1 (0.34) TDP1ALDH1A1LMNATLR7MAPT
SCHEMBL6971451 0.85 HSP90B1 (0.33) TDP1ALDH1A1SMN1; SMN2P2RX3KDM4E
SCHEMBL6975192 0.85 TDP1 (0.43) TDP1MEN1KMT2AALDH1A1LMNA
SCHEMBL6968716 0.85 TDP1 (0.42) TDP1MEN1KMT2AALDH1A1RECQL
SCHEMBL6972194 0.85 NPC1 (0.41) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL6965480 0.85 POLB (0.44) TDP1MEN1KMT2AALDH1A1RECQL

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-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed