SCHEMBL9495140

SCHEMBL9495140

CC(O)C(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].CC(O)C(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].CC(O)C(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].CC(O)C(=O)OC(CC(=O)[O-])(CC(=O)[O-])C(=O)[O-].[Ge+4].[Ge+4].[Ge+4]

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.33
CA2 P00918 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
SCHEMBL27555518 0.81 CA4 (0.40) CA4
SCHEMBL6662537 0.76 CA4 (0.45) CA4CA2
SCHEMBL986408 0.76 CA4 (0.43) CA4CA2
Water SCHEMBL9236934 0.75 CA4 (0.31) CA4
SCHEMBL5359390 0.74 SMN1; SMN2 (0.36) CA4
SCHEMBL17600559 0.74 SMN1; SMN2 (0.36) CA4
Potassium Ion SCHEMBL28245167 0.74
SCHEMBL28564581 0.72 CYP2D6 (0.35)
SCHEMBL8442297 0.71 CA4 (0.46) CA4
Glycine SCHEMBL11682691 0.70 CA4 (0.32) CA4

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-0342416-B1 MEDICINE Zoubek, Gerhard (DE) 1993-04-21 EP claimed