SCHEMBL31031493

SCHEMBL31031493

C[C@H](NC(=O)CN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TRHR P34981 1/20 0.42
▸ ACE P12821 7/20 0.41
▸ ACE2 Q9BYF1 4/20 0.41
▸ REN P00797 2/20 0.40
▸ CTSL P07711 2/20 0.39
▸ CTSS P25774 2/20 0.39
▸ CTSK P43235 2/20 0.39
▸ CTSH P09668 1/20 0.39

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
SCHEMBL31409131 0.92 TRHR (0.44) TRHRACEACE2REN
SCHEMBL31031509 0.91 CTSL (0.45) TRHRRENCTSLCTSSCTSK
SCHEMBL29925778 0.85 ACE (0.43) TRHRACEACE2REN
SCHEMBL29802223 0.84 TSHR (0.44) TRHRACEACE2
SCHEMBL29666757 0.84 ACE (0.50) ACEACE2
SCHEMBL30670295 0.84 ACE (0.42) TRHRACEACE2
SCHEMBL29630670 0.83 TRHR (0.42) TRHRACEACE2
SCHEMBL29630375 0.83 TRHR (0.41) TRHRACEACE2
SCHEMBL30274845 0.83 TRHR (0.46) TRHRACEACE2
SCHEMBL29590456 0.82 TRHR (0.41) TRHRACEACE2

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
WO-2024132725-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF INTRACRANIAL HEMORRHAGIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF INTRACRANIAL HEMORRHAGIC STROKE FROM ACUTE ISCHEMIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 — — WO claimed
Send feedback