SCHEMBL7561265

SCHEMBL7561265

O=C(O)N1C(=O)C[C@@H]1CO

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ITGB1 P05556 9/20 0.41
ITGA5 P08648 8/20 0.41
ITGA4 P13612 3/20 0.38
BRD4 O60885 1/20 0.35
ITGB3 P05106 4/20 0.33
ITGAV P06756 4/20 0.33
ITGB5 P18084 3/20 0.33
ITGB2 P05107 2/20 0.33
ITGAL P20701 2/20 0.33
ITGB6 P18564 2/20 0.33
RIPK1 Q13546 1/20 0.33
POLB P06746 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MME P08473 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
SCHEMBL3182383 0.79 ACE (0.38) ITGB1ITGA4POLBL3MBTL1
SCHEMBL3182376 0.79 ACE (0.38) ITGB1ITGA4POLBL3MBTL1
SCHEMBL6233244 0.79 ACE (0.38) ITGB1ITGA4POLBL3MBTL1
SCHEMBL248703 0.76 MME (0.43) ITGB1ITGA5ITGA4RIPK1POLB
SCHEMBL6967928 0.76 ITGB1 (0.37) ITGB1ITGA5ITGA4BRD4ITGB3
SCHEMBL6967927 0.76 ITGB1 (0.37) ITGB1ITGA5ITGA4BRD4ITGB3
SCHEMBL7386119 0.74 ITGB1 (0.51) ITGB1ITGA5ITGA4RIPK1POLB
SCHEMBL6686977 0.74 POLB (0.36) ITGB1ITGA5ITGA4POLB
SCHEMBL7680021 0.74 ITGB1 (0.51) ITGB1ITGA5ITGA4RIPK1POLB
SCHEMBL6972069 0.74 HRH3 (0.39)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1187809-A1 PROCESS FOR REDUCTION OF (2R)-4-OXOAZETIDINONE-2-CARBOXYLIC ACID ABBOTT LABORATORIES (US) 2002-03-20 EP disclosed
WO-2000076964-A1 PROCESS FOR REDUCTION OF (2R)-4-OXOAZETIDINONE-2-CARBOXYLIC ACID ABBOTT LABORATORIES (US) 2000-12-21 WO disclosed
US-6103911-A Process for reduction of (2R)-4-oxoazetidinone-2-carboxylic acid ABBOTT LABORATORIES (US) 2000-08-15 US disclosed