SCHEMBL11032563

SCHEMBL11032563

C[P@](=O)(O)N1CC(NC(=O)Cc2ccccc2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
EPHX2 P34913 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CYP1A2 P05177 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 1/20 0.43
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HRH1 P35367 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
CYP2C19 P33261 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
MAPK1 P28482 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL11032560 1.00 POLB (0.45) POLBEPHX2MEN1KMT2ACYP1A2
SCHEMBL11032561 1.00 POLB (0.45) POLBEPHX2MEN1KMT2ACYP1A2
SCHEMBL11026362 0.89 POLB (0.47) POLBEPHX2MEN1KMT2ACYP1A2
SCHEMBL11026367 0.89 POLB (0.47) POLBEPHX2MEN1KMT2ACYP1A2
SCHEMBL11271759 0.86 POLB (0.44) POLBEPHX2MEN1KMT2AL3MBTL1
SCHEMBL11058256 0.86 POLB (0.44) POLBEPHX2MEN1KMT2AL3MBTL1
SCHEMBL9781786 0.77 POLB (0.51) POLBEPHX2MEN1KMT2AL3MBTL1
SCHEMBL9781780 0.77 POLB (0.51) POLBEPHX2MEN1KMT2AL3MBTL1
SCHEMBL8017705 0.76 POLB (0.50) POLBEPHX2MEN1KMT2AL3MBTL1
SCHEMBL8017709 0.76 POLB (0.50) POLBEPHX2MEN1KMT2AL3MBTL1

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-0061765-B1 BETA-LACTAMS E.R. SQUIBB & SONS, INC. (US) 1985-08-28 EP disclosed
US-4478749-A AMINO ACID DERTIVATIVES ANTIBIOTICS E. R. SQUIBB & SONS, INC. (US) 1984-10-23 US disclosed