SCHEMBL4789304

SCHEMBL4789304

CCc1cccc(-c2c(F)cccc2C(O)(CCCNC(=O)O)C2CCCN(C(=O)[C@@H]3CCCN3C3CCNCC3)C2)c1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.73
CYP3A4 P08684 3/20 0.63

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
SCHEMBL3726287 1.00 REN (0.73) RENCYP3A4
SCHEMBL3726284 1.00 REN (0.73) RENCYP3A4
SCHEMBL4789306 1.00 REN (0.73) RENCYP3A4
SCHEMBL8154642 0.94 REN (0.84) RENCYP3A4
SCHEMBL3739534 0.91 REN (0.87) RENCYP3A4
SCHEMBL4748998 0.89 REN (0.87) RENCYP3A4
SCHEMBL3735357 0.89 REN (0.87) RENCYP3A4
SCHEMBL3730794 0.87 REN (0.87) RENCYP3A4
SCHEMBL4748654 0.86 REN (0.88) RENCYP3A4
SCHEMBL3732445 0.86 REN (0.88) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008124577-A1 RENIN INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-10-16 WO disclosed