SCHEMBL4248149

SCHEMBL4248149

CCCCOC(=O)N1CCCC(C(OCCNC(=O)OC)c2cccc(F)c2)C1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.65
CYP3A4 P08684 3/20 0.54

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
SCHEMBL14856640 0.90 REN (0.66) RENCYP3A4
SCHEMBL14856641 0.90 REN (0.66) RENCYP3A4
SCHEMBL4973694 0.87 REN (0.70) RENCYP3A4
SCHEMBL4973697 0.87 REN (0.70) RENCYP3A4
SCHEMBL2327459 0.87 REN (0.67) RENCYP3A4
SCHEMBL2327462 0.87 REN (0.67) RENCYP3A4
SCHEMBL8243520 0.87 REN (0.67) RENCYP3A4
SCHEMBL2327454 0.87 REN (0.67) RENCYP3A4
SCHEMBL4973636 0.85 REN (0.65) RENCYP3A4
SCHEMBL4973638 0.85 REN (0.65) RENCYP3A4

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-2081927-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS Vitae Pharmaceuticals, Inc. (US) 2009-07-29 EP disclosed
WO-2008036216-A1 PIPERIDINE DERIVATIVES AS RENIN INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2008-03-27 WO disclosed