SCHEMBL2816028

SCHEMBL2816028

COCCCn1c(C2CCCN(C(=O)C[C@@H](CC3CCN(C(C)=O)CC3)NC(=O)O)C2)cc2c(F)ccc(Cl)c21

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
REN P00797 20/20 0.37

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
SCHEMBL2788443 0.89 REN (0.37) REN
SCHEMBL2790585 0.82 REN (0.38) REN
SCHEMBL2790479 0.76 ALDH1A1 (0.31) REN
SCHEMBL2790483 0.76 ALDH1A1 (0.31) REN
SCHEMBL7899334 0.73 CFD (0.35)
SCHEMBL2789055 0.73 CFD (0.33)
SCHEMBL2789237 0.73 CNR2 (0.37) REN
SCHEMBL7897742 0.72 CFD (0.34)
SCHEMBL2788359 0.72 CFD (0.33)
SCHEMBL2792686 0.71 DPP4 (0.34)

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-2010111634-A2 RENIN INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-09-30 WO disclosed