SCHEMBL6865199

SCHEMBL6865199

Cn1ccc(C(=O)ON2C(=O)CCC2=O)c(OCc2ccccc2)c1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.37
HTT P42858 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
HSD17B10 Q99714 1/20 0.37
LIPG Q9Y5X9 1/20 0.36
GAA P10253 1/20 0.36
HPD P32754 1/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
ALOX12 P18054 1/20 0.35
MAPK14 Q16539 1/20 0.34
NPC1 O15118 1/20 0.34
CYP19A1 P11511 1/20 0.34
CYP11B1 P15538 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
SCHEMBL5551769 0.85 LMNA (0.42) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL2237686 0.83 ALDH1A1 (0.49) HPGDLMNAALDH1A1HTTMEN1
SCHEMBL2240565 0.81 HPGD (0.44) HPGDLMNAALDH1A1HTTMEN1
SCHEMBL17848969 0.81 KDM4E (0.47) HPGDALDH1A1HTTMEN1KMT2A
SCHEMBL19709882 0.80 MAOB (0.48) HPGDLMNAALDH1A1HTTMEN1
SCHEMBL16789591 0.79 GLRA1 (0.47) HPGDLMNAALDH1A1HTTMEN1
SCHEMBL8333370 0.74 LIPG (0.47) HPGDLMNAALDH1A1HTTMEN1
SCHEMBL6858810 0.74 LIPG (0.47) HPGDALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL13339884 0.73 SPHK2 (0.48) HPGDLMNAALDH1A1MEN1KMT2A
SCHEMBL6864646 0.72 LIPG (0.45) HPGDALDH1A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0840727-B1 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS UNIV CALIFORNIA (US) 2004-05-06 EP disclosed
US-5892029-A HIGHLY EFFECTIVE UPON BOTH INJECTION AND ORAL ADMINISTRATION. THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-04-06 US disclosed
EP-0840727-A1 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-05-13 EP disclosed
US-5624901-A CARBAMOYL SUBSTITUTED COMPOUNDS FOR CHELATE COMPOUNDS FOR MAGNETIC RESONANCE IMAGING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-04-29 US disclosed
WO-1997000245-A1 3-HYDROXY-2(1H)-PYRIDINONE CHELATING AGENTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1997-01-03 WO disclosed