SCHEMBL11300573

SCHEMBL11300573

Nc1ccncc1C1=NCCN1

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 15/20 0.52

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
SCHEMBL11284192 0.90 NISCH (0.46) NISCH
SCHEMBL80782 0.78 NISCH (0.62) NISCH
Bromide SCHEMBL82800 0.76 NISCH (0.61) NISCH
SCHEMBL12226606 0.75 NISCH (0.52) NISCH
Hydrochloric Acid SCHEMBL11299051 0.75 NISCH (0.59) NISCH
SCHEMBL18705529 0.75 NISCH (0.49) NISCH
SCHEMBL11301090 0.72 LMNA (0.53) NISCH
SCHEMBL7208490 0.70 NISCH (0.46) NISCH
SCHEMBL9579892 0.70 NISCH (0.81) NISCH
SCHEMBL5827257 0.69 NISCH (0.53) NISCH

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-0046446-A1 Polyazaheterocyclic compounds, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1982-02-24 EP disclosed