SCHEMBL31031562

SCHEMBL31031562

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

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 9/20 0.56
▸ CALCR P30988 9/20 0.56
▸ NPY2R P49146 7/20 0.56
▸ NPY4R P50391 7/20 0.56
▸ NPY5R Q15761 7/20 0.56
▸ NPY1R P25929 5/20 0.56
▸ EPHA2 P29317 2/20 0.55
▸ TFPI P10646 1/20 0.52

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
SCHEMBL31031572 0.96 RAMP3 (0.59) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031523 0.94 RAMP3 (0.53) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031556 0.94 NPY2R (0.61) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031544 0.93 RAMP3 (0.57) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30495619 0.90 NPY2R (0.62) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31031561 0.90 NPY2R (0.52) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL31683337 0.89 NPY2R (0.61) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30844327 0.89 RAMP3 (0.55) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30844303 0.89 RAMP3 (0.53) RAMP3CALCRNPY2RNPY4RNPY5R
SCHEMBL30844278 0.88 RAMP3 (0.53) RAMP3CALCRNPY2RNPY4RNPY5R

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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