SCHEMBL6002159

SCHEMBL6002159

CN(C)C(=O)[C@H]1C[C@@H](O)CN1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.50
PIK3CD O00329 4/20 0.36
ALDH1A1 P00352 1/20 0.35
MME P08473 1/20 0.34
AVPR2 P30518 1/20 0.33
DPP4 P27487 6/20 0.33
DPP8 Q6V1X1 6/20 0.33
DPP9 Q86TI2 6/20 0.33
RIPK1 Q13546 1/20 0.31
DPP7 Q9UHL4 1/20 0.31
FAP Q12884 1/20 0.31
SYK P43405 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
SCHEMBL2498387 1.00 ATM (0.50) ATMPIK3CDALDH1A1MMEAVPR2
SCHEMBL5068787 1.00 ATM (0.50) ATMPIK3CDALDH1A1MMEAVPR2
SCHEMBL20973270 1.00 ATM (0.50) ATMPIK3CDALDH1A1MMEAVPR2
SCHEMBL5065994 1.00 ATM (0.50) ATMPIK3CDALDH1A1MMEAVPR2
SCHEMBL7957159 0.84 MMP2 (0.44) ATM
SCHEMBL3891979 0.83 ATM (0.45) ATMPIK3CDALDH1A1
SCHEMBL2645663 0.83 ATM (0.45) ATMPIK3CDALDH1A1
SCHEMBL6002006 0.80 DPP4 (0.34) ATMDPP4DPP8DPP9
SCHEMBL8529323 0.80 ATM (0.30) ATM
SCHEMBL5068813 0.80 DPP4 (0.34) ATMDPP4DPP8DPP9

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
EP-1659121-A1 1,3-DIHYDRO-2H-INDOL-2-ONE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2006-05-24 EP disclosed