SCHEMBL5317099

SCHEMBL5317099

C/C(=N\O)C(C)(C)NCCONC(C)(C)/C(C)=N/O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
POLB P06746 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
SCHEMBL5313149 1.00 POLB (0.32) POLB
SCHEMBL14100048 0.83
SCHEMBL5313897 0.79 POLB (0.33) POLB
SCHEMBL4582685 0.79 POLB (0.33) POLB
Hydrochloric Acid SCHEMBL4582681 0.78 POLB (0.32) POLB
SCHEMBL8693335 0.76 POLB (0.37) POLB
SCHEMBL8693325 0.76 POLB (0.37) POLB
Upenazime SCHEMBL1477985 0.76 POLB (0.37) POLB
SCHEMBL451140 0.75 GAA (0.30)
SCHEMBL15135657 0.74 POLB (0.36) POLB

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-0629617-B2 Heteroatom-bearing ligands and metal complexes thereof BRACCO INT BV (NL) 2007-09-26 EP claimed
EP-0629617-B1 Heteroatom-bearing ligands and metal complexes thereof BRACCO INT BV (NL) 1998-04-29 EP claimed