SCHEMBL9566602

SCHEMBL9566602

O=C([O-])CN(CCCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O=C([O-])CN(CCCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].O=C([O-])CN(CCCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-].[Fe+3].[Fe+3].[Fe+3].[Fe+3].[KH]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
ALOX15 P16050 2/20 0.54
MAPT P10636 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 2/20 0.38
EYA2 O00167 1/20 0.38
APP P05067 1/20 0.38
ACE P12821 1/20 0.38
BLM P54132 2/20 0.36
PMP22 Q01453 2/20 0.36
LMNA P02545 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2A P08913 1/20 0.36
TSHR P16473 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
CYP2C19 P33261 1/20 0.36
ADRA1A P35348 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL5495954 0.97 KDM4E (0.56) KDM4EALOX15MAPTSMN1; SMN2TDP1
Potassium Ion SCHEMBL9566492 0.95 KDM4E (0.54) KDM4EALOX15MAPTSMN1; SMN2TDP1
SCHEMBL5690756 0.95 KDM4E (0.60) KDM4EALOX15MAPTSMN1; SMN2TDP1
Water SCHEMBL7566259 0.92 KDM4E (0.52) KDM4EALOX15MAPTSMN1; SMN2TDP1
SCHEMBL2331738 0.92 KDM4E (0.62) KDM4EALOX15MAPTSMN1; SMN2TDP1
Potassium Ion SCHEMBL9336388 0.92 KDM4E (0.56) KDM4EALOX15MAPTSMN1; SMN2TDP1
SCHEMBL9308039 0.92 KDM4E (0.56) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL9054100 0.86 KDM4E (0.68) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL9054050 0.86 KDM4E (0.68) KDM4EALOX15MAPTSMN1; SMN2TDP1
Edetic Acid SCHEMBL65335 0.86 KDM4E (0.68) KDM4EALOX15MAPTSMN1; SMN2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0559276-A1 Processing photographic colour negative films KODAK LIMITED (GB) 1993-09-08 EP disclosed