Acetone

Acetone

SCHEMBL2118253

C=C(C(N)=O)C(=O)O.CC(C)=O.CC(C)=O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53
LDHA P00338 1/20 0.44
LDHB P07195 1/20 0.44
LMNA P02545 2/20 0.39
ALOX15 P16050 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
ACHE P22303 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 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
SCHEMBL386035 0.91
SCHEMBL8528077 0.81 LDHA (0.50) TDP1LDHALDHBLMNABLM
SCHEMBL9741940 0.79 LDHA (0.47) TDP1LDHALDHBACHE
Methacrylic Acid SCHEMBL27591808 0.79 TDP1 (0.75) TDP1LDHALDHBLMNAALOX15
Methacrylic Acid SCHEMBL16107800 0.75 TDP1 (0.80) TDP1LDHALDHBLMNAALOX15
SCHEMBL490237 0.75
Oxalic Acid SCHEMBL27308680 0.75 TDP1 (0.80) TDP1LDHALDHBLMNAALOX15
Methacrylic Acid SCHEMBL2232984 0.75 TDP1 (0.69) TDP1LDHALDHBLMNAALOX15
Methacrylic Acid SCHEMBL28866418 0.75 TDP1 (0.80) TDP1LDHALDHBLMNAALOX15
SCHEMBL27466443 0.75

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
US-20160156039-A1 BINDER COMPOSITION FOR NON-AQUEOUS SECONDARY BATTERY ELECTRODE TOYO INK SC HOLDINGS CO., LTD. (JP) 2016-06-02 US claimed
US-9905855-B2 Binder composition for non-aqueous secondary battery electrode TOYO INK SC HOLDINGS CO., LTD. (JP) 2018-02-27 US disclosed
US-20160156039-A1 BINDER COMPOSITION FOR NON-AQUEOUS SECONDARY BATTERY ELECTRODE TOYO INK SC HOLDINGS CO., LTD. (JP) 2016-06-02 US disclosed
US-20120095131-A1 BINDER COMPOSITION FOR NON-AQUEOUS SECONDARY BATTERY ELECTRODE TOYOCHEM CO., LTD. (JP) 2012-04-19 US disclosed