SCHEMBL10748375

SCHEMBL10748375

CN(C)C(=O)CC(Cc1cccc2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)NN

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 8/20 0.43
▸ MMP9 P14780 4/20 0.42
▸ MMP8 P22894 3/20 0.42
▸ MMP2 P08253 3/20 0.42
▸ HRH4 Q9H3N8 1/20 0.40
▸ CTSS P25774 1/20 0.39
▸ CTSK P43235 1/20 0.39
▸ MME P08473 1/20 0.38
▸ ACE P12821 1/20 0.38
▸ CPA1 P15085 1/20 0.38
▸ ACE2 Q9BYF1 1/20 0.38
▸ MMP14 P50281 1/20 0.36
▸ MMP1 P03956 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL10751443 0.88 HRH4 (0.45) RENMMP9MMP8MMP2HRH4
SCHEMBL10748522 0.88 MMP2 (0.46) RENMMP9MMP8MMP2HRH4
SCHEMBL8486522 0.84 MMP9 (0.55) RENMMP9MMP8MMP2HRH4
SCHEMBL8486527 0.84 MMP9 (0.55) RENMMP9MMP8MMP2HRH4
SCHEMBL10751142 0.84 REN (0.47) RENMMP9MMP8MMP2HRH4
SCHEMBL8485799 0.83 CTSS (0.46) RENMMP9MMP8MMP2HRH4
SCHEMBL8485801 0.83 CTSS (0.46) RENMMP9MMP8MMP2HRH4
SCHEMBL10753464 0.83 REN (0.48) RENMMP9MMP8MMP2HRH4
SCHEMBL10522999 0.82 KMT2A (0.44) RENMMP9MMP8MMP2HRH4
SCHEMBL8484198 0.82 MMP2 (0.55) RENMMP9MMP8MMP2HRH4

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-4656269-A RENIN INHIBITORY EFFECT WHEN ADMINISTERING ORALLY; HYPOTENSIVE AGENTS KISSEI PHARMACEUTICAL CO., LTD. (JP) 1987-04-07 — — US disclosed
EP-0200406-A2 Novel amino acid derivatives Kissei Pharmaceutical Co. Ltd. (JP) 1986-11-05 — — EP disclosed
Send feedback