Acetone

Acetone

SCHEMBL11245784

CC(C)=O.CC(C)=O.O=S(O)O.OSO

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
CA1 P00915 2/20 0.46
CA2 P00918 1/20 0.46
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 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
Sulfurous Acid SCHEMBL11253416 0.89
Acetone SCHEMBL22235 0.88
Acetone SCHEMBL31094925 0.84
Acetone SCHEMBL6314334 0.84
Acetone SCHEMBL22774108 0.83
Acetone SCHEMBL27660019 0.80 CA1 (0.50) LMNACA1CA2TSHRTHPO
Acetone SCHEMBL3331905 0.80 CA1 (0.50) LMNACA1CA2TSHRTHPO
Sulfurous Acid SCHEMBL28202153 0.79
Acetone SCHEMBL10795850 0.77 LMNA (0.46) LMNACA1CA2TSHRTHPO
Acetone SCHEMBL27459409 0.75 LMNA (0.55) LMNACA1CA2TSHRTHPO

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
US-4360632-A Ketone bisulfites as reducing agent for free radical polymerization AIR PRODUCTS AND CHEMICALS, INC. (US) 1982-11-23 US disclosed