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SCHEMBL31034420

SCHEMBL31034420

CC(C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 7/20 0.55
▸ NPY4R P50391 7/20 0.55
▸ NPY5R Q15761 7/20 0.55
▸ NPY1R P25929 5/20 0.55
▸ IL23R Q5VWK5 1/20 0.54
▸ RAMP3 O60896 1/20 0.54
▸ CALCR P30988 1/20 0.54
▸ TFPI P10646 4/20 0.54
▸ KDM1A O60341 2/20 0.54
▸ APLNR P35414 1/20 0.53
▸ C5AR1 P21730 1/20 0.53

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
SCHEMBL31031557 0.96 APLNR (0.56) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL31031551 0.90 APLNR (0.59) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31031566 0.89 CALCRL (0.52) CALCR
SCHEMBL31182885 0.87 NPY2R (0.57) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30804666 0.86 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL29463786 0.86 NPY2R (0.61) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL29463778 0.86 NPY2R (0.61) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30429249 0.85 NPY2R (0.65) NPY2RNPY4RNPY5RNPY1RRAMP3
SCHEMBL30974199 0.85 NMUR2 (0.57) RAMP3CALCRKDM1A
SCHEMBL30906415 0.84 CALCRL (0.53) RAMP3CALCRAPLNR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4390398-B1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF INTRACRANIAL HEMORRHAGIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF INTRACRANIAL HEMORRHAGIC STROKE FROM ACUTE ISCHEMIC STROKE UNIV GDANSKI (PL) 2025-07-23 — — EP claimed
EP-4390398-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) 2024-06-26 — — EP claimed
EP-4390398-B1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF INTRACRANIAL HEMORRHAGIC STROKE IN HUMANS AND DIFFERENTIAL DIAGNOSIS OF INTRACRANIAL HEMORRHAGIC STROKE FROM ACUTE ISCHEMIC STROKE UNIV GDANSKI (PL) 2025-07-23 — — EP disclosed
EP-4390398-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) 2024-06-26 — — EP disclosed
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