SCHEMBL6983494

SCHEMBL6983494

OCC(O)CNC[C@H](O)[C@@H](O)[C@@H](O)[C@H](O)CO

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
LMNA P02545 4/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TDP1 Q9NUW8 1/20 0.50
PDE4A P27815 1/20 0.38
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
TYMP P19971 1/20 0.35
PNP P00491 1/20 0.31
THRB P10828 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL7694338 1.00 KDM4E (0.54) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL1399177 1.00 KDM4E (0.54) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL8535158 0.95 KDM4E (0.48) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL9444635 0.93 KDM4E (0.56) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL9444652 0.90 LMNA (0.65) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL724112 0.90 LMNA (0.65) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL5551085 0.90 LMNA (0.65) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL29344590 0.90 LMNA (0.65) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL6484167 0.85 LMNA (0.40) KDM4ELMNAL3MBTL1TDP1ALDH1A1
SCHEMBL8533676 0.85 KDM4E (0.56) KDM4ELMNAL3MBTL1TDP1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1183255-B1 BICYCLIC POLYAMINOACID METAL COMPLEXES, METHOD FOR PREPARING SAME AND USE IN MEDICAL IMAGING GUERBET SA (FR) 2003-03-05 EP disclosed
EP-0922700-B1 Metal chelates of macrocyclic polyaminocarboxylic derivatives and their use for the diagnostic imaging GUERBET SA (FR) 2002-09-11 EP disclosed
US-6440956-B1 Bicyclic polyaminoacid metal complexes, their process of preparation and their application in medical imaging GUERBET (FR) 2002-08-27 US disclosed
EP-1183255-A1 BICYCLIC POLYAMINOACID METAL COMPLEXES, METHOD FOR PREPARING SAME AND USE IN MEDICAL IMAGING GUERBET (FR) 2002-03-06 EP disclosed
US-6187285-B1 IN PARTICULAR MAGNETIC RESONANCE IMAGING (MRI) FOR MAGNETIC CATIONS. GUERBET (FR) 2001-02-13 US disclosed
WO-2000075141-A1 BICYCLIC POLYAMINOACID METAL COMPLEXES, METHOD FOR PREPARING SAME AND USE IN MEDICAL IMAGING GUERBET (FR) 2000-12-14 WO disclosed
EP-0922700-A1 Metal chelates of macrocyclic polyaminocarboxylic derivatives and their use for the diagnostic imaging GUERBET (FR) 1999-06-16 EP disclosed