SCHEMBL31726922

SCHEMBL31726922

CC(O)c1ccc(NC(=O)OC(C)(C)C)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.43
▸ GSK3B P49841 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ DEGS1 O15121 2/20 0.41
▸ NAMPT P43490 2/20 0.40
▸ GRIN2B Q13224 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ CYP17A1 P05093 1/20 0.40
▸ BCL2 P10415 1/20 0.39
▸ TRPA1 O75762 1/20 0.39
▸ ATR Q13535 1/20 0.39
▸ MAPKAPK2 P49137 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ F13A1 P00488 1/20 0.37
▸ TGM2 P21980 1/20 0.37
▸ TGM1 P22735 1/20 0.37
▸ FFAR2 O15552 1/20 0.37
▸ PTGER1 P34995 1/20 0.37
▸ AAK1 Q2M2I8 1/20 0.36

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
SCHEMBL30506468 0.90 DEGS1 (0.48) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL22606745 0.90 DEGS1 (0.48) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL16296314 0.87 GSK3B (0.41) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL28071467 0.87 GSK3B (0.41) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL24738966 0.87 GSK3B (0.43) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL27946209 0.86 MAPK1 (0.42) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL31727221 0.82 NAMPT (0.41) MAPK1GSK3BDYRK1ADEGS1NAMPT
SCHEMBL29457481 0.80 DHODH (0.47) GSK3BDYRK1ADEGS1NAMPTGRIN2B
SCHEMBL23107411 0.80 NAMPT (0.48) MAPK1GSK3BDYRK1ANAMPTGRIN2B
SCHEMBL6058763 0.80 CYP17A1 (0.39) MAPK1GSK3BDYRK1ADEGS1NAMPT

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-2025235363-A1 CYCLIN-DEPENDENT KINASE 4 DEGRADERS BLUEPRINT MEDICINES CORPORATION (US) 2025-11-13 — — WO disclosed
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