SCHEMBL30734152

SCHEMBL30734152

CC(C)(C)OC(=O)N1CCN(c2ccccc2F)C(=O)C1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
SCN9A Q15858 4/20 0.51
SCN5A Q14524 1/20 0.51
GRM5 P41594 1/20 0.47
GRM1 Q13255 1/20 0.47
TP53 P04637 1/20 0.46
THRB P10828 1/20 0.46
MAPK1 P28482 1/20 0.45
P2RX7 Q99572 3/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NR1H2 P55055 2/20 0.43
KDM4E B2RXH2 1/20 0.42
ALOX15 P16050 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42

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
SCHEMBL1583488 1.00 MEN1 (0.51) MEN1KMT2ASCN9ASCN5AGRM5
SCHEMBL7535800 0.86 SMARCA2 (0.49) MAPK1P2RX7MAPTSMN1; SMN2NR1H2
SCHEMBL3653185 0.86 P2RX7 (0.55) GRM5GRM1MAPK1P2RX7MAPT
SCHEMBL2889747 0.85 SCN9A (0.49) MEN1KMT2ASCN9ASCN5AGRM5
SCHEMBL4537183 0.85 P2RX7 (0.55) P2RX7SMN1; SMN2
SCHEMBL1663013 0.85 P2RX7 (0.56) MEN1KMT2AMAPK1P2RX7
SCHEMBL29507776 0.84 NR1H2 (0.54) P2RX7SMN1; SMN2NR1H2
SCHEMBL22650493 0.84 NR1H2 (0.54) P2RX7SMN1; SMN2NR1H2
SCHEMBL1662960 0.84 P2RX7 (0.44) TP53THRBP2RX7MAPTNR1H2
SCHEMBL1663068 0.83 GRM5 (0.51) SCN9ASCN5AGRM5GRM1MAPK1

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-4543888-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF Arizona Board of Regents on behalf of The University of Arizona (US) 2025-04-30 EP disclosed
WO-2023250083-A1 SMALL MOLECULE INHIBITORS OF DYRK/CLK AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2023-12-28 WO disclosed