SCHEMBL29138705

SCHEMBL29138705

C#CCNn1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.41
HPGD P15428 1/20 0.40
TK1 P04183 4/20 0.37
ALDH1A1 P00352 2/20 0.35
TYMP P19971 2/20 0.35
LMNA P02545 1/20 0.35
ALB P02768 1/20 0.35
POLB P06746 1/20 0.35
ADRA1A P35348 1/20 0.35
BLM P54132 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL16588800 0.79 MAPK1 (0.40) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL21284209 0.74 MAPK1 (0.43) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL6250948 0.73 MAPK1 (0.38) MAPK1HPGDTK1ALDH1A1LMNA
SCHEMBL25979517 0.73 MAPK1 (0.42) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL8304489 0.73 MAPK1 (0.42) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL13403292 0.72 MAPK1 (0.54) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL7200749 0.68 HPGD (0.41) MAPK1HPGDTK1
SCHEMBL15688254 0.67 HPGD (0.50) MAPK1HPGDTK1
SCHEMBL646139 0.64 TDP1 (0.59) MAPK1HPGDTK1ALDH1A1TYMP
SCHEMBL16248 0.64 MAPK1 (0.47) MAPK1HPGDTK1ALDH1A1TYMP

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-115867670-A Base-modified nucleotides as substrates for TDT-based enzyme nucleic acids 伊鲁米纳新加坡有限公司 2023-03-28 CN disclosed