SCHEMBL28453918

SCHEMBL28453918

CC=Cn1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 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
SCHEMBL10946833 0.80 — —
SCHEMBL28354702 0.75 — —
SCHEMBL869033 0.70 — —
SCHEMBL10943010 0.69 — —
SCHEMBL2436127 0.69 — —
Ethylene SCHEMBL28232523 0.67 — —
SCHEMBL28223413 0.65 MAPK1 (0.43) TYMP
SCHEMBL633410 0.64 CSNK2A2 (0.41) —
Acetaldehyde SCHEMBL28241137 0.62 TSHR (0.46) TYMP
SCHEMBL9062088 0.62 IDH1 (0.33) —

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-107408734-B Nonaqueous electrolyte solution and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-08-18 — — CN disclosed
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