SCHEMBL30449152

SCHEMBL30449152

CCC(=O)n1cnc2c(Cl)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.52
FGFR1 P11362 9/20 0.50
FGFR4 P22455 9/20 0.50
P2RX7 Q99572 2/20 0.47
FDPS P14324 1/20 0.46
HDAC6 Q9UBN7 2/20 0.44
DGAT1 O75907 1/20 0.36
ADORA2A P29274 1/20 0.34
ADORA1 P30542 1/20 0.34
PI4KA P42356 1/20 0.34
PI4K2B Q8TCG2 1/20 0.34
PI4K2A Q9BTU6 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
LMNA P02545 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TYMP P19971 1/20 0.34
FLT4 P35916 1/20 0.33
KDR P35968 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
SCHEMBL29274097 0.81 GSK3B (0.73) GSK3BADORA2AADORA1PI4KAPI4K2B
SCHEMBL3273477 0.79 GSK3B (0.49) GSK3BFGFR1FGFR4P2RX7FDPS
SCHEMBL8849512 0.76 FGFR1 (0.41) GSK3BFGFR1FGFR4P2RX7FDPS
SCHEMBL5106770 0.75 P2RX7 (0.41) GSK3BFGFR1FGFR4P2RX7FDPS
SCHEMBL28020916 0.72 P2RX7 (0.64) FGFR1FGFR4P2RX7FDPSHDAC6
SCHEMBL12113556 0.72 GSK3B (0.40) GSK3BFLT4KDR
SCHEMBL12113561 0.72 GSK3B (0.40) GSK3BADORA2AADORA1PI4KAPI4K2B
SCHEMBL7832523 0.71 ADORA2A (0.64) FGFR1FGFR4P2RX7FDPSHDAC6
SCHEMBL9073828 0.71 FDPS (0.42) GSK3BFGFR1FGFR4P2RX7FDPS
SCHEMBL23885424 0.70 P2RX7 (0.66) FGFR1FGFR4P2RX7FDPSHDAC6

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-116332934-A Synthesis process of tenofovir intermediate 江苏阿尔法药业股份有限公司 2023-06-27 CN disclosed