SCHEMBL2989784

SCHEMBL2989784

COCCCOc1cc(C(=O)N(CC2CNCC2NC(=O)C(O)c2ccccc2)C(C)C)ccc1OC

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.83
CYP3A4 P08684 3/20 0.76

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
SCHEMBL2934572 1.00 REN (0.83) RENCYP3A4
SCHEMBL13177147 0.91 REN (1.00) RENCYP3A4
SCHEMBL2931372 0.88 REN (1.00) RENCYP3A4
SCHEMBL2937888 0.88 REN (1.00) RENCYP3A4
SCHEMBL3610366 0.87 REN (1.00) RENCYP3A4
SCHEMBL13177261 0.87 REN (1.00) RENCYP3A4
SCHEMBL8262175 0.87 REN (1.00) RENCYP3A4
SCHEMBL2938221 0.86 REN (1.00) RENCYP3A4
SCHEMBL2937558 0.86 REN (0.79) RENCYP3A4
SCHEMBL2934449 0.86 REN (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836163-B1 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2010-09-22 EP disclosed
EP-1836163-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN Novartis AG (CH) 2007-09-26 EP disclosed
WO-2006066896-A2 PYRROLIDINE DERIVATIVES FOR THE TREATMENT OF A DISEASE DEPENDING ON THE ACTIVITY OF RENIN NOVARTIS AG (CH) 2006-06-29 WO disclosed