SCHEMBL30898243

SCHEMBL30898243

CC(C)(C)NC(=O)OCCc1cccc(CO)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.43
PDK1 Q15118 1/20 0.40
PDK2 Q15119 1/20 0.40
PDK3 Q15120 1/20 0.40
PDK4 Q16654 1/20 0.40
CYP4F2 P78329 3/20 0.39
CYP4A11 Q02928 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPT P10636 1/20 0.39
TYR P14679 1/20 0.38
GLA P06280 1/20 0.38
DAO P14920 1/20 0.37
CTSK P43235 1/20 0.36
IKBKB O14920 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 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
SCHEMBL30898286 0.92 NPC1 (0.46) PDK1PDK2PDK3PDK4CYP4F2
SCHEMBL27832828 0.87 LOXL2 (0.46) MGLLCYP4F2CYP4A11NPC1RAB9A
SCHEMBL28776560 0.86 TYR (0.53) MGLLTYRCA12CA1CA4
SCHEMBL27642716 0.85 PRKCA (0.44) MGLLPDK1PDK2PDK3PDK4
SCHEMBL27787225 0.84 MAOA (0.42) MGLLNPC1RAB9AMAPTTYR
SCHEMBL27718558 0.84 TAAR1 (0.45) MGLLNPC1RAB9AGLACTSK
SCHEMBL27720152 0.84 TAAR1 (0.45) MGLLNPC1RAB9ASMN1; SMN2
SCHEMBL23630606 0.83 NPC1 (0.55) MGLLNPC1RAB9AMAPTGLA
SCHEMBL27718552 0.81 CNR1 (0.43) MGLLPDK1PDK2PDK3PDK4
SCHEMBL27809141 0.80 CYP2D6 (0.47) RAB9AMAPTRECQLSMN1; SMN2

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-2024105159-A1 LIGANDS OF THE M6A-RNA READERS UNIVERSITY OF ZURICH (CH) 2024-05-23 WO disclosed