SCHEMBL1940320

SCHEMBL1940320

COc1ccccc1COCCCOc1ccc(C2C(COC[C@H]3COC(C)(C)O3)CN(C(=O)OC(C)(C)C)C[C@@H]2OCc2cc(OC)c3ccccc3c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 19/20 0.52
PDE4B Q07343 1/20 0.36

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
SCHEMBL6887078 1.00 REN (0.52) RENPDE4B
SCHEMBL1940321 1.00 REN (0.52) RENPDE4B
SCHEMBL1941728 1.00 REN (0.52) RENPDE4B
SCHEMBL1941709 0.95 REN (0.55) RENPDE4B
SCHEMBL1943045 0.93 REN (0.56) RENPDE4B
SCHEMBL1942427 0.91 REN (0.50) RENPDE4B
SCHEMBL1941800 0.91 REN (0.50) RENPDE4B
SCHEMBL1941796 0.91 REN (0.50) RENPDE4B
SCHEMBL1942041 0.89 REN (0.59) RENPDE4B
SCHEMBL1941811 0.89 REN (0.59) RENPDE4B

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-1175400-B1 RENIN INHIBITORS HOFFMANN LA ROCHE (CH) 2011-06-15 EP disclosed