SCHEMBL4583859

SCHEMBL4583859

COCCCN1CCOc2ccc(CO[C@H]3CN(C(=O)C(N)CC(C)C)[C@@H](CC(C)(C)NC(C)=O)C[C@@H]3c3ccc(COCCOC)cc3)cc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.31
REN P00797 1/20 0.30

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
SCHEMBL4583857 1.00 RORC (0.31) RORCREN
SCHEMBL4582216 0.94 REN (0.31) RORCREN
SCHEMBL4582218 0.94 REN (0.31) RORCREN
SCHEMBL4582196 0.94 REN (0.31) RORCREN
SCHEMBL4582191 0.94 REN (0.31) RORCREN
SCHEMBL4583009 0.94 REN (0.31) RORCREN
SCHEMBL4583006 0.94 REN (0.31) RORCREN
SCHEMBL4582737 0.92 REN (0.31) RORCREN
SCHEMBL4582339 0.91 REN (0.30) REN
SCHEMBL4582337 0.91 REN (0.30) 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-1908762-A2 Organic compounds Speedel Experimenta AG (CH) 2008-04-09 EP disclosed