SCHEMBL10725349

SCHEMBL10725349

CCC(C)[C@@H](CO)NC(=O)CP(=O)(O)C(CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 6/20 0.56
▸ CTSB P07858 3/20 0.56
▸ REN P00797 5/20 0.51
▸ CASP3 P42574 1/20 0.46
▸ MME P08473 1/20 0.46
▸ ECE1 P42892 1/20 0.46
▸ CTSD P07339 1/20 0.45
▸ ACE2 Q9BYF1 1/20 0.44
▸ MMP3 P08254 1/20 0.44
▸ CAPN1 P07384 2/20 0.43
▸ CAPN2 P17655 1/20 0.43

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
SCHEMBL10724160 0.93 CTSB (0.49) CTSKCTSBRENCASP3MME
SCHEMBL10720236 0.92 CTSB (0.49) CTSKCTSBRENCASP3MME
SCHEMBL10725450 0.91 REN (0.50) CTSKCTSBRENCASP3MME
SCHEMBL10722068 0.91 CTSB (0.48) CTSKCTSBRENCASP3MME
SCHEMBL10720888 0.85 REN (0.61) CTSKCTSBRENCTSD
SCHEMBL10720900 0.85 REN (0.61) CTSKCTSBRENCTSD
SCHEMBL10724666 0.84 CTSK (0.56) CTSKCTSBRENCASP3CTSD
SCHEMBL10724673 0.84 CTSK (0.56) CTSKCTSBRENCASP3CTSD
SCHEMBL10725334 0.83 REN (0.62) CTSKCTSBRENCASP3CTSD
SCHEMBL10725341 0.83 REN (0.62) CTSKCTSBRENCASP3CTSD

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
US-4698329-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1987-10-06 — — US disclosed
EP-0152255-A2 New renin-inhibitory peptides and their use SANKYO COMPANY LIMITED (JP) 1985-08-21 — — EP disclosed
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