SCHEMBL8254479

SCHEMBL8254479

COCCCCC1(CNC(=O)[C@@H]2CNCC(C(=O)NCC(C)C)C2)c2ccccc2Oc2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
REN P00797 17/20 0.72
L3MBTL1 Q9Y468 1/20 0.34
TSHR P16473 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
SCHEMBL8256616 1.00 REN (0.72) RENL3MBTL1TSHR
SCHEMBL8254744 0.90 REN (0.76) RENL3MBTL1TSHR
SCHEMBL8253747 0.88 REN (0.72) RENTSHR
SCHEMBL8255158 0.87 REN (0.71) RENTSHR
SCHEMBL8248077 0.85 REN (0.74) RENL3MBTL1TSHR
SCHEMBL4902246 0.85 REN (0.55) REN
SCHEMBL4903306 0.85 REN (0.55) REN
SCHEMBL4902242 0.85 REN (0.55) REN
SCHEMBL4835867 0.84 REN (1.00) RENTSHR
SCHEMBL4907824 0.81 REN (1.00) RENL3MBTL1TSHR

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
WO-2006117183-A1 3 -M0N0- AND 3 , 5-DISUBSTITUTED PIPERIDINE DERIVATIVES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-09 WO disclosed