SCHEMBL16360509

SCHEMBL16360509

COCCCn1nc(C)c2c(C(F)(F)F)cc(CN(C(=O)[C@H]3CNCCO3)C3CC3)cc21

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.73

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
SCHEMBL13131774 0.92 REN (0.72) REN
SCHEMBL12524583 0.91 REN (0.72) REN
SCHEMBL13131656 0.90 REN (0.74) REN
SCHEMBL19526750 0.90 REN (0.74) REN
SCHEMBL13131752 0.89 REN (0.64) REN
SCHEMBL2805908 0.85 REN (0.73) REN
SCHEMBL12525889 0.85 REN (1.00) REN
SCHEMBL16471490 0.85 REN (1.00) REN
SCHEMBL13131637 0.83 REN (0.65) REN
SCHEMBL13131763 0.83 REN (0.67) 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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