SCHEMBL30974089

SCHEMBL30974089

C[C@@H](O)[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 14/20 0.49
▸ CALCR P30988 14/20 0.49
▸ NMUR2 Q9GZQ4 4/20 0.48
▸ NMUR1 Q9HB89 4/20 0.48
▸ CXCR4 P61073 1/20 0.45

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
SCHEMBL30974258 0.95 RAMP3 (0.48) RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30974241 0.92 RAMP3 (0.49) RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30974223 0.92 RAMP3 (0.49) RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30974331 0.92 RAMP3 (0.49) RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30974187 0.92 RAMP3 (0.48) RAMP3CALCRNMUR2NMUR1CXCR4
SCHEMBL30974442 0.89 RAMP3 (0.55) RAMP3CALCRNMUR2NMUR1
SCHEMBL30974421 0.88 RAMP3 (0.54) RAMP3CALCRNMUR2NMUR1
SCHEMBL30974375 0.87 CXCR4 (0.58) CXCR4
SCHEMBL30974512 0.84 TFPI (0.41) RAMP3CALCR
SCHEMBL31026877 0.83 RAMP3 (0.54) RAMP3CALCR

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-2024132726-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIWERSYTET GDANSKI (PL) 2024-06-27 — — WO claimed
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