Acetone

Acetone

SCHEMBL8932744

CC(C)=O.ClCC(Cl)(Cl)Cl

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
CA4 P22748 2/20 0.33
TP53 P04637 1/20 0.33
TRPA1 O75762 1/20 0.32
HSD17B10 Q99714 1/20 0.32
THPO P40225 1/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 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
Acetic Acid SCHEMBL10866598 0.90 FFAR3 (0.47) LMNAALDH1A1TSHRTDP1CA4
Trichloroethane SCHEMBL9544417 0.79 TSHR (0.43) LMNAALDH1A1TSHRTDP1CA4
SCHEMBL28540217 0.79 TSHR (0.41) ALDH1A1TSHRTP53
Propionic Acid SCHEMBL5972065 0.78 FFAR3 (0.59) ALDH1A1TSHRTDP1TP53HSD17B10
Ethane SCHEMBL11666836 0.76
Acetone SCHEMBL4095931 0.76 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL1244296 0.76 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL6859109 0.76 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL6859028 0.76 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4
Acetone SCHEMBL1831044 0.76 LMNA (0.60) LMNAALDH1A1TSHRTDP1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996024558-A1 METHOD AND APPARATUS FOR THERMAL DECOMPOSITION AND SEPARATION OF COMPONENTS WITHIN AN AQUEOUS STREAM HPR CORPORATION (US) 1996-08-15 WO disclosed
US-4210449-A PRINTING PLATES, PHOTORESISTS, HALOGRAPHY AMERICAN CAN COMPANY (US) 1980-07-01 US disclosed
US-4071671-A RECORDING MATERIALS AMERICAN CAN COMPANY (US) 1978-01-31 US disclosed
US-4056393-A Method of recording information using a copolymer of glycidyl methacrylate and allyl glycidyl ether AMERICAN CAN COMPANY (US) 1977-11-01 US disclosed
US-4054455-A CATALYTIC PHOTOPOLYMERIZATION AMERICAN CAN COMPANY (US) 1977-10-18 US disclosed
US-4054452-A PHOTORESISTS AMERICAN CAN COMPANY (US) 1977-10-18 US disclosed
US-4054451-A Method of polymerizing a copolymer of glycidyl methacrylate and allyl glycidyl ether AMERICAN CAN COMPANY (US) 1977-10-18 US disclosed
US-4054635-A RECORDING AND STORING INFORMATION AMERICAN CAN COMPANY (US) 1977-10-18 US disclosed