SCHEMBL10721070

SCHEMBL10721070

CCC(C)C(NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C(O)C(=O)NCc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 3/20 0.49
▸ CTSB P07858 2/20 0.47
▸ CTSK P43235 2/20 0.47
▸ MAPT P10636 2/20 0.46
▸ GAA P10253 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ CASP3 P42574 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ PSMB1 P20618 2/20 0.43
▸ MME P08473 1/20 0.43
▸ ACE P12821 1/20 0.43
▸ CPA1 P15085 1/20 0.43
▸ ACE2 Q9BYF1 1/20 0.43
▸ NMBR P28336 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41

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
SCHEMBL10720582 1.00 REN (0.49) RENCTSBCTSKMAPTGAA
SCHEMBL10720576 1.00 REN (0.49) RENCTSBCTSKMAPTGAA
SCHEMBL10721073 1.00 REN (0.49) RENCTSBCTSKMAPTGAA
SCHEMBL10724400 1.00 REN (0.49) RENCTSBCTSKMAPTGAA
SCHEMBL10724620 0.89 REN (0.52) RENCTSBCTSKCASP3MME
SCHEMBL10725026 0.89 REN (0.52) RENCTSBCTSKMAPTCASP3
SCHEMBL10720077 0.89 REN (0.52) RENCTSBCTSKMAPTCASP3
SCHEMBL10724684 0.89 REN (0.52) RENCTSBCTSKCASP3MME
SCHEMBL10720886 0.89 REN (0.52) RENCTSBCTSKCASP3MME
SCHEMBL10724707 0.89 REN (0.52) RENCTSBCTSKCASP3MME

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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