SCHEMBL6971244

SCHEMBL6971244

[N]C1CCCCC(C=Cc2nccs2)N1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RIOK2 Q9BVS4 1/20 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
SCHEMBL6971249 0.75 NLRP3 (0.32)
SCHEMBL6971243 0.75 NLRP3 (0.32)
SCHEMBL6978835 0.75 NLRP3 (0.32)
SCHEMBL15870899 0.66 RIOK2 (0.49) RIOK2
SCHEMBL6980218 0.63 CHRM2 (0.36)
SCHEMBL6974405 0.62 NLRP3 (0.31)
SCHEMBL6974409 0.62 NLRP3 (0.31)
SCHEMBL4258001 0.62 L3MBTL1 (0.39)
SCHEMBL4258006 0.62 L3MBTL1 (0.39)
SCHEMBL7392190 0.60

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-0821674-B1 CYCLIC AMIDINO AGENTS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS SEARLE & CO (US) 2003-08-06 EP claimed