SCHEMBL31031543

SCHEMBL31031543

CC(C)C[C@H](NC(=O)[C@H](C)N)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 15/20 0.66
▸ CALCR P30988 15/20 0.66
▸ EP300 Q09472 1/20 0.56
▸ HIF1A Q16665 1/20 0.56
▸ NPY2R P49146 3/20 0.55
▸ NPY4R P50391 3/20 0.55
▸ NPY5R Q15761 3/20 0.55
▸ NPY1R P25929 2/20 0.55

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
SCHEMBL31031585 0.95 RAMP3 (0.63) RAMP3CALCREP300HIF1ANPY2R
SCHEMBL31031451 0.92 RAMP3 (0.54) RAMP3CALCREP300HIF1A
SCHEMBL30974349 0.90 RAMP3 (0.69) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30648440 0.90 RAMP3 (0.65) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30726569 0.90 RAMP3 (0.63) RAMP3CALCREP300HIF1ANPY2R
SCHEMBL30974597 0.90 RAMP3 (0.68) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31182857 0.89 NPY2R (0.62) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL29479782 0.88 EP300 (0.60) RAMP3CALCREP300HIF1ANPY2R
SCHEMBL31716428 0.88 RAMP3 (0.68) RAMP3CALCR
SCHEMBL30607296 0.88 NPY2R (0.63) RAMP3CALCREP300HIF1ANPY2R

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 disclosed
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