Acetone

Acetone

SCHEMBL28265166

CC(C)=O.COC(C)(C)CCO

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
TDP1 Q9NUW8 2/20 0.38
TSHR P16473 1/20 0.38
GAA P10253 1/20 0.34
LMNA P02545 3/20 0.33
CYP3A4 P08684 1/20 0.33
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
HSD17B10 Q99714 1/20 0.30

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
Acetic Acid SCHEMBL865213 0.93 ALDH1A1 (0.36) ALDH1A1TDP1TSHRGAALMNA
SCHEMBL64765 0.89
Ethylene Glycol SCHEMBL28232976 0.87 ALDH1A1 (0.43) ALDH1A1TDP1TSHR
SCHEMBL28320588 0.87
SCHEMBL2591293 0.87
Water SCHEMBL27934281 0.87 ALDH1A1 (0.43) ALDH1A1TDP1TSHR
Methoxymethane SCHEMBL1476203 0.87 ALDH1A1 (0.43) ALDH1A1TDP1TSHR
Alcohol SCHEMBL7098336 0.84 ALDH1A1 (0.48) ALDH1A1TDP1TSHR
Isopropyl Alcohol SCHEMBL20607574 0.80 TDP1 (0.38) ALDH1A1TDP1TSHRLMNACYP3A4
Isobutanol SCHEMBL1774638 0.78 TSHR (0.43) ALDH1A1TDP1TSHR

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
CN-109111813-A Antifogging agent composition and antifogging article having antifogging coating film 日油株式会社 2019-01-01 CN disclosed