SCHEMBL16360476

SCHEMBL16360476

Cc1cn(CCCO)c2cc(CN(C(=O)[C@H]3CNCCN3)C3CC3)ccc12

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.59

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
SCHEMBL16360457 0.82 REN (0.71) REN
SCHEMBL13131472 0.77 REN (0.75) REN
SCHEMBL13131528 0.76 REN (0.71) REN
SCHEMBL2807237 0.75 REN (0.60) REN
SCHEMBL12524585 0.74 REN (1.00) REN
SCHEMBL16471494 0.74 REN (1.00) REN
SCHEMBL13131643 0.69 REN (0.58) REN
SCHEMBL18508869 0.68 REN (0.73) REN
SCHEMBL13131518 0.68 REN (0.79) REN
SCHEMBL13131578 0.68 REN (0.73) REN

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
WO-2012124775-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND 田辺三菱製薬株式会社 (JP) 2012-09-20 — — WO disclosed
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