SCHEMBL12526795

SCHEMBL12526795

C=C(OC)n1nc(C(C)N(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C2CC2)c2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 18/20 0.48
▸ USP30 Q70CQ3 2/20 0.37

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
SCHEMBL16459588 0.93 REN (0.48) RENUSP30
SCHEMBL15435778 0.93 REN (0.48) RENUSP30
SCHEMBL15417888 0.91 REN (0.47) RENUSP30
SCHEMBL16471525 0.89 REN (0.47) RENUSP30
SCHEMBL16471560 0.85 REN (0.68) REN
SCHEMBL16471562 0.84 REN (0.69) REN
SCHEMBL16471568 0.83 REN (0.69) REN
SCHEMBL15435780 0.82 REN (0.58) REN
SCHEMBL16471583 0.82 REN (0.58) REN
SCHEMBL16471528 0.80 REN (0.53) 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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