SCHEMBL1039409

SCHEMBL1039409

COCCCN1CCOc2ccc(CO[C@H]3CN(C(=O)O)C(C(C)(C)C)[C@@H](OCCC(C)O)[C@H]3c3ccc(OC)cc3)cc21

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.34
REN P00797 1/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL1039410 1.00 RORC (0.34) RORCRENLMNA
SCHEMBL1040451 0.93 REN (0.33) RORCREN
SCHEMBL1039352 0.93 REN (0.33) REN
SCHEMBL1039350 0.93 REN (0.33) REN
SCHEMBL1040452 0.93 REN (0.33) RORCREN
SCHEMBL1039803 0.92 REN (0.34) RENLMNA
SCHEMBL1036447 0.91 REN (0.33) RORCREN
SCHEMBL1036449 0.91 REN (0.33) RORCREN
SCHEMBL1037890 0.90 REN (0.31) REN
SCHEMBL1037889 0.90 REN (0.31) 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-2049514-B1 NITRATE ESTERS OF PIPERIDINES NOVARTIS AG (CH) 2011-01-26 EP disclosed