SCHEMBL30765376

SCHEMBL30765376

CS(=O)(=O)c1cccc(-c2ccnc3cc(-c4ccc(C(=O)N5CC(O)C5)nc4)oc23)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 4/20 0.39
TAB1 Q15750 4/20 0.39
ROCK2 O75116 1/20 0.37
MTOR P42345 2/20 0.35
PIK3CB P42338 1/20 0.35
PRKDC P78527 1/20 0.35
ATM Q13315 1/20 0.35
ATR Q13535 1/20 0.35
ATRIP Q8WXE1 1/20 0.35
ACVR1 Q04771 1/20 0.34
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
CAMKK2 Q96RR4 2/20 0.33
GABRA1 P14867 1/20 0.33
PDE10A Q9Y233 1/20 0.33
RAF1 P04049 1/20 0.33
BRAF P15056 1/20 0.33
EIF4A3 P38919 1/20 0.33
KCNH2 Q12809 3/20 0.33
JAK3 P52333 2/20 0.32

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
SCHEMBL27260978 1.00 MAP3K7 (0.39) MAP3K7TAB1ROCK2MTORPIK3CB
SCHEMBL27260891 0.84 MAP3K7 (0.38) MAP3K7TAB1ROCK2PDE10A
SCHEMBL30765195 0.82 MAP3K7 (0.37) MAP3K7TAB1ROCK2MTORPIK3CB
SCHEMBL30765354 0.81 FGFR3 (0.36) MTORGABRA1PDE10A
SCHEMBL27261209 0.81 FGFR3 (0.36) MTORGABRA1PDE10A
SCHEMBL27260619 0.78 NR1H2 (0.41) MAP3K7TAB1MTORPIK3CBATR
SCHEMBL30765258 0.78 GABRA1 (0.35) ROCK2GABRA1PDE10A
SCHEMBL27260720 0.76 MTOR (0.42) MAP3K7TAB1MTORPIK3CBPRKDC
SCHEMBL27260617 0.76 KCNH2 (0.47) MAP3K7TAB1ACVR1NR1H2NR1H3
SCHEMBL30765359 0.75 HSD17B10 (0.44)

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-2024033280-A1 FUROPYRIDIN AND FUROPYRIMIDIN, INHIBITORS OF PI4K, FOR USE IN THE TREATMENT OF PARASITE INFECTION AND MALARIA MERCK PATENT GMBH (DE) 2024-02-15 WO disclosed