SCHEMBL30908221

SCHEMBL30908221

CC(=O)N(Cc1ccc2ccc(NC(=O)OC(C)(C)C)nc2c1)c1cn(C)nc1C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 3/20 0.42
GSK3B P49841 1/20 0.36
DYRK1A Q13627 1/20 0.36
MAPK14 Q16539 1/20 0.33
GRM2 Q14416 2/20 0.32
SCN9A Q15858 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
STING1 Q86WV6 2/20 0.30
HTR6 P50406 1/20 0.30

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
SCHEMBL30908240 0.93 GSK3B (0.37) IRAK4GSK3BDYRK1AMAPK14SCN9A
SCHEMBL30908217 0.92 GSK3B (0.37) IRAK4GSK3BDYRK1AMAPK14SCN9A
SCHEMBL30908165 0.92 GSK3B (0.36) IRAK4GSK3BDYRK1AMAPK14SCN9A
SCHEMBL30908596 0.88 GSK3B (0.39) IRAK4GSK3BDYRK1AMAPK14SCN9A
SCHEMBL30908400 0.86 STING1 (0.40) IRAK4GSK3BDYRK1ASTING1
SCHEMBL30908563 0.86 GSK3B (0.36) IRAK4GSK3BDYRK1AMAPK14SCN9A
SCHEMBL30908147 0.86 GSK3B (0.33) IRAK4GSK3BDYRK1A
SCHEMBL30908442 0.82 AURKA (0.37) GRM2SCN9A
SCHEMBL30908587 0.81 HTR6 (0.37) HTR6
SCHEMBL30908271 0.79 PTPN1 (0.36) SCN9A

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
WO-2024074611-A1 PRMT5 INHIBITORS Ryvu Therapeutics S.A. (PL) 2024-04-11 WO disclosed