SCHEMBL15435701

SCHEMBL15435701

COCC[C@@H](C)Oc1nc([C@@H](C)N(C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)C2CC2)nc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 20/20 0.55

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
SCHEMBL16360452 0.91 REN (0.68) REN
SCHEMBL12526906 0.91 REN (0.68) REN
SCHEMBL16471522 0.87 REN (0.58) REN
SCHEMBL16471543 0.79 REN (0.65) REN
SCHEMBL16360453 0.78 REN (0.44) REN
SCHEMBL16471569 0.78 REN (0.44) REN
SCHEMBL15417903 0.78 REN (0.58) REN
SCHEMBL19526595 0.76 REN (0.48) REN
SCHEMBL16471560 0.76 REN (0.68) REN
SCHEMBL16471562 0.76 REN (0.69) 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
EP-2687518-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND Mitsubishi Tanabe Pharma Corporation (JP) 2014-01-22 — — EP disclosed
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