SCHEMBL8456330

SCHEMBL8456330

CCOC(=O)CC(NCCNCC(=O)O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
EGLN1 Q9GZT9 1/20 0.37
ALDH1A1 P00352 4/20 0.35
CYP2D6 P10635 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LTA4H P09960 4/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
GLO1 Q04760 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
TSHR P16473 1/20 0.32
TRPA1 O75762 1/20 0.32
POLB P06746 1/20 0.31

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
SCHEMBL20188848 0.98 GAA (0.36) GAAMGAMSIMGAM2EGLN1
SCHEMBL5015012 0.80 CA2 (0.38) GAASMN1; SMN2MAPTCA2
SCHEMBL28973013 0.80 KMT2A (0.40) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL25825870 0.79 L3MBTL1 (0.44) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL23248621 0.79 CA2 (0.37) GAASMN1; SMN2MAPTCA2
SCHEMBL8935945 0.79 CA2 (0.37) GAASMN1; SMN2MAPTCA2
SCHEMBL10694971 0.78 ALDH1A1 (0.31) ALDH1A1HPGD
SCHEMBL8911606 0.77 CA1 (0.34) CA1CA2TSHR
SCHEMBL10697008 0.77 TSHR (0.32) TSHR
SCHEMBL22316560 0.77 NOD1 (0.44) GAAMGAMSIMGAM2KMT2A

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-0430863-B2 Complexe builders bonded to sterwise prepared polymers, their complexes and conjugates, process for their preparation and pharmaceutical agents containing the same SCHERING AG (DE) 1999-08-25 EP disclosed
EP-0430863-A2 Complexe builders bonded to sterwise prepared polymers, their complexes and conjugates, process for their preparation and pharmaceutical agents containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1991-06-05 EP disclosed
EP-0336879-A1 Meso-tetraphenylporphyrin complex compounds,process for their preparation and pharmaceuticals containing them SCHERING AKTIENGESELLSCHAFT (DE) 1989-10-11 EP disclosed