SCHEMBL25095092

SCHEMBL25095092

CC(C)[C@H](C)N1CCN(C(=O)OC(C)(C)C)CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 2/20 0.40
ATM Q13315 1/20 0.40
ESR2 Q92731 1/20 0.40
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
MAPK1 P28482 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.39
EPHX2 P34913 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ADORA1 P30542 1/20 0.37
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
DDB1 Q16531 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
SCHEMBL25088953 1.00 NR1H2 (0.41) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL21696862 0.90 NR1H2 (0.40) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL16132815 0.88 P2RX7 (0.45) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL15110168 0.84 HTT (0.42) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL8399546 0.79 P2RX7 (0.53) NR1H2HTTATMESR2MAPT
SCHEMBL25422301 0.78 USP2 (0.47) NR1H2USP2SMN1; SMN2ESR2MAPT
SCHEMBL23722977 0.78 MAPK1 (0.41) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL23722978 0.78 MAPK1 (0.41) NR1H2USP2SMN1; SMN2HTTATM
SCHEMBL15342771 0.78 ALDH1A1 (0.45) NR1H2SMN1; SMN2HTTATMESR2
SCHEMBL2393299 0.77 ALDH1A1 (0.44) NR1H2HTTATMESR2MAPT

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-2023023942-A1 HPK1 INHIBITORS, COMPOSITIONS COMPRISING HPK1 INHIBITOR, AND METHODS OF USING THE SAME BIOFRONT LTD (CAYMAN) (KY) 2023-03-02 WO disclosed