Acetophenone

Acetophenone

SCHEMBL10453049

CC(=O)c1ccccc1.O=S(=O)(O)Cl

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
HPGD P15428 3/20 0.50
ALDH1A1 P00352 3/20 0.50
LMNA P02545 2/20 0.50
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
CES2 O00748 3/20 0.48
CES1 P23141 3/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
PKM P14618 1/20 0.44
MEN1 O00255 1/20 0.44
DAO P14920 1/20 0.44
TSHR P16473 1/20 0.44
NAPRT Q6XQN6 1/20 0.44

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
Acetophenone SCHEMBL2186216 0.93 MAPT (0.58) MAPTSMN1; SMN2HPGDALDH1A1LMNA
Acetophenone SCHEMBL9029344 0.88 SMN1; SMN2 (0.58) MAPTSMN1; SMN2HPGDALDH1A1LMNA
Acetophenone SCHEMBL11757006 0.86 SMN1; SMN2 (0.60) MAPTSMN1; SMN2HPGDALDH1A1LMNA
Acetophenone SCHEMBL30537005 0.85
Acetophenone SCHEMBL1450855 0.85
Acetophenone SCHEMBL30537000 0.85
Acetophenone SCHEMBL27462873 0.85 MAPT (0.71) MAPTSMN1; SMN2HPGDALDH1A1LMNA
Acetophenone SCHEMBL737 0.85
Acetophenone SCHEMBL16745259 0.85
Acetophenone SCHEMBL719033 0.85 MAPT (0.71) MAPTSMN1; SMN2HPGDALDH1A1LMNA

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-0221344-B1 SULPHONYL-PHENYL ALKYL AMINES, PROCESS FOR THEIR PREPARATION AND MEDICINES Roche Diagnostics GmbH (DE) 1990-05-23 EP disclosed
EP-0221344-A1 Sulphonyl-phenyl alkyl amines, process for their preparation and medicines Roche Diagnostics GmbH (DE) 1987-05-13 EP disclosed
EP-0031954-B1 SULPHONAMIDES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1984-03-14 EP disclosed
EP-0031954-A2 Sulphonamides, process for their preparation and medicines containing these compounds Roche Diagnostics GmbH (DE) 1981-07-15 EP disclosed