SCHEMBL8587998

SCHEMBL8587998

[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Cu+2].[Fe+3]

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CA4 P22748 1/20 0.50
CA2 P00918 1/20 0.50

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
SCHEMBL352283 0.89
SCHEMBL11061081 0.89 CA1 (0.60) CA1CA4CA2
SCHEMBL11759143 0.89 CA1 (0.60) CA1CA4CA2
SCHEMBL897385 0.89 CA1 (0.60) CA1CA4CA2
SCHEMBL8729736 0.89 CA1 (0.60) CA1CA4CA2
SCHEMBL17438 0.89
SCHEMBL11781321 0.80
Potassium Ion SCHEMBL12495614 0.80 CA1 (0.50) CA1CA4CA2
Ammonia Solution, Strong SCHEMBL9347224 0.80
Potassium Ion SCHEMBL394118 0.80 CA1 (0.50) CA1CA4CA2

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
US-5837145-A Method for treating water contaminated with cyanide ALUMINUM COMPANY OF AMERICA (US) 1998-11-17 US disclosed
US-4428840-A DEMETALLIZATION OF MINING EFLLUENTS HOMESTAKE MINING COMPANY (US) 1984-01-31 US disclosed