SCHEMBL11436794

SCHEMBL11436794

CC(=O)SCCC(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 16/20 0.54
▸ PLK1 P53350 1/20 0.49
▸ CTSD P07339 1/20 0.48
▸ TRHR P34981 1/20 0.46

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
SCHEMBL11435650 0.89 REN (0.56) RENPLK1CTSDTRHR
SCHEMBL11436783 0.85 PSMB9 (0.43) RENPLK1
SCHEMBL11436789 0.85 PSMB9 (0.43) RENPLK1
SCHEMBL17226098 0.81 REN (0.61) RENPLK1CTSDTRHR
SCHEMBL7852891 0.79 REN (0.65) RENPLK1CTSD
SCHEMBL7842935 0.79 REN (0.65) RENPLK1CTSD
SCHEMBL7849192 0.79 REN (0.65) RENPLK1CTSD
SCHEMBL13470161 0.78 REN (0.56) RENPLK1CTSDTRHR
SCHEMBL31435690 0.77 REN (0.58) RENCTSDTRHR
SCHEMBL23743861 0.76 SLC15A2 (0.63) RENTRHR

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
US-4216209-A Tripeptide angiotensin converting enzyme inhibitors AMERICAN HOME PRODUCTS CORPORATION (US) 1980-08-05 — — US disclosed
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