SCHEMBL31031546

SCHEMBL31031546

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

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 3/20 0.67
▸ MAOB P27338 1/20 0.65
▸ KDM5A P29375 1/20 0.65
▸ KDM1B Q8NB78 1/20 0.65
▸ NPY2R P49146 7/20 0.63
▸ NPY4R P50391 7/20 0.63
▸ NPY5R Q15761 7/20 0.63
▸ NPY1R P25929 5/20 0.63
▸ TFPI P10646 6/20 0.60
▸ RAMP3 O60896 1/20 0.59
▸ CALCR P30988 1/20 0.59
▸ NMUR2 Q9GZQ4 1/20 0.57
▸ NMUR1 Q9HB89 1/20 0.57

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
SCHEMBL31031455 0.96 KDM1A (0.65) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30974622 0.92 KDM1A (0.62) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30176462 0.92 NPY2R (0.68) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL29395807 0.92 KDM1A (0.64) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30607429 0.92 NPY2R (0.66) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30432704 0.91 NPY2R (0.68) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30834205 0.90 NPY2R (0.66) KDM1ANPY2RNPY4RNPY5RNPY1R
SCHEMBL29973053 0.90 NMUR2 (0.62) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL29521532 0.90 KDM1A (0.66) KDM1AMAOBKDM5AKDM1BNPY2R
SCHEMBL30495741 0.90 KDM1A (0.70) KDM1AMAOBKDM5AKDM1BNPY2R

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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