SCHEMBL5682102

SCHEMBL5682102

O=C([O-])CO[N+](=O)[O-].O=C([O-])CO[N+](=O)[O-].[Mn+2]

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
CA4 P22748 2/20 0.32

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
SCHEMBL10595194 0.95 ALDH1A1 (0.40) ALDH1A1CA4
SCHEMBL11292216 0.95 ALDH1A1 (0.40) ALDH1A1CA4
Ammonia Solution, Strong SCHEMBL2788239 0.92 ALDH1A1 (0.39) ALDH1A1CA4
Acetic Acid SCHEMBL11420712 0.84 ALDH1A1 (0.33) ALDH1A1
SCHEMBL456770 0.76
SCHEMBL28104919 0.76
Boric Acid SCHEMBL14954725 0.74 GSR (0.35) ALDH1A1
SCHEMBL2011628 0.74
SCHEMBL12787733 0.74
SCHEMBL28948850 0.74

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1617947-A1 MANGANESE BASED OZONE DECOMPOSITION CATALYST AND PROCESS FOR ITS PREPARATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2006-01-25 EP disclosed
WO-2004096435-A1 MANGANESE OZONE DECOMPOSITION CATALYSTS AND PROCESS FOR ITS PREPARATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2004-11-11 WO disclosed