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SCHEMBL30974385

SCHEMBL30974385

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 1/20 0.59
▸ OPRM1 P35372 2/20 0.58
▸ OPRD1 P41143 2/20 0.58
▸ OPRK1 P41145 2/20 0.58
▸ NTSR1 P30989 5/20 0.57
▸ NTSR2 O95665 4/20 0.57
▸ SORT1 Q99523 2/20 0.57
▸ SLC6A2 P23975 1/20 0.55
▸ NPY2R P49146 4/20 0.55
▸ NPY4R P50391 4/20 0.55
▸ NPY5R Q15761 4/20 0.55
▸ NPY1R P25929 3/20 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
SCHEMBL30974423 0.98 NTSR1 (0.58) CALCRLOPRM1OPRD1OPRK1NTSR1
SCHEMBL30974357 0.97 NTSR1 (0.57) CALCRLOPRM1OPRD1OPRK1NTSR1
SCHEMBL30262120 0.91 NTSR1 (0.59) NTSR1NTSR2SORT1SLC6A2NPY2R
SCHEMBL31575697 0.90 CALCRL (0.63) CALCRLOPRM1OPRD1OPRK1
SCHEMBL31575703 0.90 NTSR1 (0.60) OPRM1OPRD1OPRK1NTSR1NTSR2
SCHEMBL30432274 0.89 NTSR2 (0.59) CALCRLOPRM1OPRD1OPRK1NTSR1
SCHEMBL30327364 0.88 OPRM1 (0.54) OPRM1OPRD1OPRK1NTSR1NTSR2
SCHEMBL29714014 0.88 NTSR1 (0.64) OPRM1NTSR1NTSR2SORT1
SCHEMBL31182993 0.88 OPRM1 (0.65) OPRM1OPRD1OPRK1NPY2RNPY4R
SCHEMBL30571136 0.87 NTSR1 (0.60) OPRM1OPRD1OPRK1NTSR1NTSR2

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-4390399-B1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DAIGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIV GDANSKI (PL) 2025-07-16 — — EP claimed
EP-4390399-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DAIGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE Uniwersytet Gdanski (PL) 2024-06-26 — — EP claimed
EP-4390399-B1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DAIGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE UNIV GDANSKI (PL) 2025-07-16 — — EP disclosed
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 disclosed
EP-4390399-A1 SERUM PEPTIDE PATTERNS FOR DIAGNOSTICS OF ACUTE ISCHEMIC STROKE IN HUMANS AND DIFFERENTIAL DAIGNOSIS OF ACUTE ISCHEMIC STROKE FROM INTRACRANIAL HEMORRHAGIC STROKE Uniwersytet Gdanski (PL) 2024-06-26 — — EP disclosed
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