SCHEMBL7209148

SCHEMBL7209148

CC(C)[C@H](NCCCN)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
GABRR1 P24046 2/20 0.39
PLA2G2A P14555 1/20 0.38
PLA2G5 P39877 1/20 0.38
GSR P00390 1/20 0.36
PAOX Q6QHF9 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
EPHX2 P34913 2/20 0.35
RNPEP Q9H4A4 1/20 0.35
CPB2 Q96IY4 1/20 0.34

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
SCHEMBL27698867 1.00 SMN1; SMN2 (0.42) SMN1; SMN2GABRR1PLA2G2APLA2G5GSR
SCHEMBL3188611 0.88 GABRR1 (0.46) SMN1; SMN2GABRR1PLA2G2APLA2G5NPSR1
SCHEMBL2232656 0.88 GABRR1 (0.46) SMN1; SMN2GABRR1PLA2G2APLA2G5NPSR1
SCHEMBL2232653 0.88 GABRR1 (0.46) SMN1; SMN2GABRR1PLA2G2APLA2G5NPSR1
SCHEMBL4622349 0.83 SMN1; SMN2 (0.46) SMN1; SMN2PLA2G2APLA2G5NPSR1
SCHEMBL11582357 0.82 SMN1; SMN2 (0.56) SMN1; SMN2PLA2G2APLA2G5
SCHEMBL3360269 0.82 SMN1; SMN2 (0.43) SMN1; SMN2PLA2G2APLA2G5NPSR1EPHX2
SCHEMBL30001304 0.82 SMN1; SMN2 (0.43) SMN1; SMN2PLA2G2APLA2G5NPSR1EPHX2
SCHEMBL11582359 0.82 SMN1; SMN2 (0.56) SMN1; SMN2PLA2G2APLA2G5
SCHEMBL31390813 0.81 CA12 (0.44) SMN1; SMN2PAOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1068224-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS Du Pont Pharmaceuticals Company (US) 2001-01-17 EP claimed
WO-1999058162-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS DU PONT PHARMACEUTICALS COMPANY (US) 1999-11-18 WO claimed
EP-1337278-A2 SIMULTANEOUS IMAGING OF CARDIAC PERFUSION AND A VITRONECTIN RECEPTOR TARGETED IMAGING AGENT Bristol-Myers Squibb Medical Imaging, Inc. (US) 2003-08-27 EP disclosed
EP-1311302-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS Bristol-Myers Squibb Pharma Company (US) 2003-05-21 EP disclosed
WO-2002055111-A2 SIMULTANEOUS IMAGING OF CARDIAC PERFUSION AND A VITRONECTIN RECEPTOR TARGETED IMAGING AGENT BRISTOL MYERS SQUIBB MEDICAL I (US) 2002-07-18 WO disclosed
WO-2001097860-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS FOR USE IN COMBINATION THERAPY BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-12-27 WO disclosed
CN-1295578-A Pharmaceuticals for imaging of angiogenic disorders PONT PHARMACEUTICAL CO DU (US) 2001-05-16 CN disclosed
EP-1068224-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS Du Pont Pharmaceuticals Company (US) 2001-01-17 EP disclosed
WO-1999058162-A2 PHARMACEUTICALS FOR THE IMAGING OF ANGIOGENIC DISORDERS DU PONT PHARMACEUTICALS COMPANY (US) 1999-11-18 WO disclosed