SCHEMBL24327073

SCHEMBL24327073

C[C@@H]1CC(C(N)=O)N(C(=O)CC(C)(C)C)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PEPD P12955 1/20 0.34
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
ATM Q13315 1/20 0.31
PIK3CD O00329 2/20 0.31
PIK3CA P42336 2/20 0.31
PIK3CG P48736 1/20 0.31
DPP4 P27487 2/20 0.31
DPP8 Q6V1X1 2/20 0.31
DPP9 Q86TI2 2/20 0.31
CCR2 P41597 1/20 0.30

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
SCHEMBL883190 1.00 PEPD (0.34) PEPDCTSSCTSKMAOAMAOB
SCHEMBL22511867 0.89 ATM (0.42) ATMPIK3CDPIK3CAPIK3CGDPP4
SCHEMBL7945978 0.89 ATM (0.42) ATMPIK3CDPIK3CAPIK3CGDPP4
SCHEMBL22512115 0.89 ATM (0.42) ATMPIK3CDPIK3CAPIK3CGDPP4
SCHEMBL22511873 0.89 ATM (0.42) ATMPIK3CDPIK3CAPIK3CGDPP4
SCHEMBL22796893 0.89 ATM (0.42) ATMPIK3CDPIK3CAPIK3CGDPP4
SCHEMBL8203665 0.75 ATM (0.48) PEPDCTSKMAOAMAOBATM
SCHEMBL24440243 0.75 CCR2 (0.31) CCR2
SCHEMBL8328572 0.74 CHRM2 (0.41) PEPD
SCHEMBL22402907 0.73 ATM (0.61) ATMPIK3CDDPP4DPP8DPP9

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-2022068933-A1 COMPOUNDS AND METHODS OF TREATING DISEASES CULLGEN (SHANGHAI) , INC. (CN) 2022-04-07 WO disclosed