SCHEMBL5505093

SCHEMBL5505093

COCCCN1CCOc2ccc(COC3CN(S(=O)(=O)c4ccc(C)cc4)[C@H](CO[Si](C(C)C)(C(C)C)C(C)C)CC3c3ccc(CO)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.33
REN P00797 1/20 0.32
RORC P51449 6/20 0.31
KMT2A Q03164 2/20 0.31
POLB P06746 1/20 0.30
MEN1 O00255 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
SCHEMBL1041031 1.00 CYP2C9 (0.33) CYP2C9RENRORCKMT2APOLB
SCHEMBL4959527 0.95 REN (0.32) CYP2C9RENRORCKMT2A
SCHEMBL1517996 0.94 REN (0.32) CYP2C9RENRORCKMT2A
SCHEMBL2918847 0.94 FKBP1A (0.33) CYP2C9RENRORCKMT2APOLB
SCHEMBL1040945 0.94 LMNA (0.32) CYP2C9RENRORCPOLB
SCHEMBL1517809 0.92 REN (0.31) CYP2C9REN
SCHEMBL2389129 0.90 REN (0.31) REN
SCHEMBL4959467 0.87 CYP2C9 (0.36) CYP2C9RENRORCKMT2APOLB
SCHEMBL2920405 0.86 FKBP1A (0.36) CYP2C9KMT2A
SCHEMBL2920447 0.85 RORC (0.36) CYP2C9RORCKMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1863803-A2 SUBSTITUTED PIPERIDINES Speedel Experimenta AG (CH) 2007-12-12 EP disclosed
WO-2006103277-A2 2 , 4 , 5-SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS SPEEDEL EXPERIMENTA AG (CH) 2006-10-05 WO disclosed