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SCHEMBL31031522

SCHEMBL31031522

CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 4/20 0.58
▸ F2 P00734 4/20 0.57
▸ C5AR1 P21730 2/20 0.56
▸ CRHR1 P34998 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ HCRTR1 O43613 1/20 0.53
▸ HCRTR2 O43614 1/20 0.53
▸ OPRD1 P41143 2/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ NPY1R P25929 1/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPY4R P50391 1/20 0.51
▸ NPY5R Q15761 1/20 0.51
▸ CCKBR P32239 2/20 0.50
▸ GLP1R P43220 2/20 0.50

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
SCHEMBL30974376 0.95 F2 (0.58) CALCRF2C5AR1CRHR1CRHR2
SCHEMBL30974240 0.95 F2 (0.58) CALCRF2C5AR1CRHR1CRHR2
SCHEMBL30974481 0.92 C5AR1 (0.61) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974459 0.91 C5AR1 (0.60) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974387 0.90 C5AR1 (0.59) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974458 0.90 C5AR1 (0.59) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974554 0.90 C5AR1 (0.58) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974573 0.89 C5AR1 (0.57) CALCRF2C5AR1GLP1R
SCHEMBL30974286 0.89 F2 (0.57) CALCRF2C5AR1NPY1RNPY2R
SCHEMBL30974189 0.88 F2 (0.56) CALCRF2C5AR1GLP1R

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 5 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
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
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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