SCHEMBL28985694

SCHEMBL28985694

Cc1cn(C(C)C(N)=O)c(=O)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYMP P19971 3/20 0.40
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
ALB P02768 1/20 0.38
POLB P06746 1/20 0.38
ADRA1A P35348 1/20 0.38
BLM P54132 1/20 0.38
MAPK1 P28482 1/20 0.37
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
TK1 P04183 1/20 0.35

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
SCHEMBL8045280 0.85 HPGD (0.41) TYMPALDH1A1LMNAALBPOLB
SCHEMBL4194708 0.79 MAPK1 (0.41) TYMPALDH1A1LMNAALBPOLB
SCHEMBL9155069 0.79 TYMP (0.43) TYMPALDH1A1LMNAALBPOLB
SCHEMBL29254559 0.78 ALDH1A1 (0.38) TYMPALDH1A1LMNAALBPOLB
SCHEMBL784395 0.78 MAPK1 (0.43) TYMPALDH1A1LMNAALBPOLB
SCHEMBL13310896 0.77 MAPK1 (0.42) TYMPALDH1A1LMNAALBPOLB
SCHEMBL31389027 0.76 TK1 (0.37) TYMPALDH1A1LMNAALBPOLB
SCHEMBL22759941 0.75 MAPK1 (0.41) TYMPALDH1A1LMNAALBPOLB
SCHEMBL3930328 0.73 HPGD (0.43) TYMPALDH1A1LMNAALBPOLB
SCHEMBL21511226 0.72 MAPK1 (0.39) TYMPALDH1A1LMNAALBPOLB

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
CN-115960480-B Light response self-repairing material containing thymine derivative and application thereof 合肥工业大学 2023-09-12 CN claimed
CN-115960480-A Light response self-repairing material containing thymine derivative and application thereof 合肥工业大学 2023-04-14 CN claimed
CN-115960480-B Light response self-repairing material containing thymine derivative and application thereof 合肥工业大学 2023-09-12 CN disclosed
CN-115960480-A Light response self-repairing material containing thymine derivative and application thereof 合肥工业大学 2023-04-14 CN disclosed