SCHEMBL30974005

SCHEMBL30974005

C[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)O)[C@@H](C)O

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PRMT1 Q99873 1/20 0.63
▸ NPBWR1 P48145 4/20 0.54
▸ IL23R Q5VWK5 7/20 0.52
▸ OPRM1 P35372 1/20 0.50
▸ OPRD1 P41143 1/20 0.50
▸ GHSR Q92847 1/20 0.49
▸ GLP1R P43220 2/20 0.49

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
SCHEMBL30974422 0.97 PRMT1 (0.65) PRMT1NPBWR1IL23ROPRM1OPRD1
SCHEMBL30973994 0.93 PRMT1 (0.58) PRMT1NPBWR1IL23ROPRM1OPRD1
SCHEMBL30974062 0.92 PRMT1 (0.57) PRMT1NPBWR1IL23ROPRM1OPRD1
SCHEMBL30974279 0.92 PRMT1 (0.55) PRMT1NPBWR1IL23ROPRM1OPRD1
SCHEMBL30974132 0.92 PRMT1 (0.64) PRMT1NPBWR1IL23RGHSRGLP1R
SCHEMBL11407870 0.89 IL23R (0.59) PRMT1IL23R
SCHEMBL11407920 0.89 IL23R (0.59) PRMT1IL23R
SCHEMBL30566944 0.87 IL23R (0.57) PRMT1IL23ROPRM1OPRD1GHSR
SCHEMBL30974377 0.87 GHSR (0.57) IL23RGHSR
SCHEMBL30974434 0.86 GHSR (0.56) GHSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
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