SCHEMBL7327167

SCHEMBL7327167

CCC(O)CC(O)[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
REN P00797 16/20 0.50
CTSD P07339 1/20 0.50
CTSE P14091 1/20 0.50
CTSS P25774 2/20 0.49
CTSK P43235 2/20 0.49

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
SCHEMBL7273787 0.90 REN (0.50) RENCTSDCTSECTSSCTSK
SCHEMBL3606572 0.90 CTSS (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL3606570 0.90 CTSS (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL3606578 0.90 CTSS (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL7281729 0.88 REN (0.56) RENCTSDCTSECTSSCTSK
SCHEMBL7284721 0.87 CTSS (0.55) RENCTSDCTSECTSSCTSK
SCHEMBL7326076 0.86 REN (0.51) RENCTSDCTSECTSSCTSK
SCHEMBL7334713 0.86 CTSS (0.50) RENCTSDCTSECTSSCTSK
SCHEMBL7304354 0.86 CTSS (0.53) RENCTSDCTSECTSSCTSK
SCHEMBL7297295 0.86 CTSS (0.52) RENCTSDCTSECTSSCTSK

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
EP-0396065-A1 Novel amino acid derivatives possessing renin-inhibitory activities Japan Tobacco Inc. (JP) 1990-11-07 EP disclosed