SCHEMBL30722754

SCHEMBL30722754

CNC(=O)c1c(NC(=O)OC(C)(C)C)cnc(Cl)c1F

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATR Q13535 1/20 0.40
METAP1 P53582 1/20 0.36
P2RX3 P56373 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
MAPKAPK2 P49137 3/20 0.34
CYP17A1 P05093 1/20 0.34
NAMPT P43490 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MET P08581 1/20 0.34
TRPA1 O75762 1/20 0.33
LCK P06239 1/20 0.33
KCNQ4 P56696 1/20 0.33
KCNQ5 Q9NR82 1/20 0.33
STK17B O94768 1/20 0.33
STK17A Q9UEE5 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
SCHEMBL26697706 0.87 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL29936130 0.86 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL26894606 0.86 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL19960768 0.82 ATR (0.43) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL26988407 0.81 BRD4 (0.35) KCNQ5
SCHEMBL23291067 0.81 ATR (0.42) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL30038835 0.81 ATR (0.42) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL2019695 0.81 ATR (0.42) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL21789258 0.80 ATR (0.41) ATRMETAP1P2RX3AAK1MAPKAPK2
SCHEMBL29143532 0.78 ATR (0.42) ATRMETAP1P2RX3AAK1MAPKAPK2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4551575-A2 TREM2 MODULATORS Muna Therapeutics ApS (DK) 2025-05-14 EP disclosed
WO-2024008722-A2 TREM2 MODULATORS MUNA THERAPEUTICS APS (DK) 2024-01-11 WO disclosed