SCHEMBL7435175

SCHEMBL7435175

CCCC(=O)C(=O)[C@H](CC1CCCCC1)N(C(=O)[C@@H](N)Cc1ccccc1)[C@@H](CC(C)C)C(=O)NC(=O)C1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 5/20 0.41
▸ PSEN1 P49768 4/20 0.39
▸ PSEN2 P49810 4/20 0.39
▸ APH1B Q8WW43 4/20 0.39
▸ NCSTN Q92542 4/20 0.39
▸ APH1A Q96BI3 4/20 0.39
▸ PSENEN Q9NZ42 4/20 0.39
▸ CTSD P07339 4/20 0.38
▸ REN P00797 5/20 0.38

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
SCHEMBL7429756 0.88 REN (0.44) REN
SCHEMBL10520747 0.86 PSMB5 (0.42) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL7493678 0.81 PSMB5 (0.42) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL7431811 0.81 PSMB5 (0.41) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL7432319 0.79 PSMB5 (0.40) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL10522879 0.79 PSMB5 (0.38) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL10522535 0.74 REN (0.45) REN
SCHEMBL7435172 0.73 PSMB5 (0.60) PSMB5PSEN1PSEN2APH1BNCSTN
SCHEMBL7433145 0.70 REN (0.44) REN
SCHEMBL9574983 0.68 REN (0.46) REN

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4820691-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1989-04-11 — — US claimed
EP-0296581-A2 Amino acid 1,2-diketo derivatives as renin inhibitors E.R. SQUIBB & SONS, INC. (US) 1988-12-28 — — EP claimed
US-4820691-A HYPOTENSIVE AGENTS E. R. SQUIBB & SONS, INC. (US) 1989-04-11 — — US disclosed
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