SCHEMBL31497309

SCHEMBL31497309

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCN)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 1/20 0.63
▸ ACE P12821 4/20 0.57
▸ OPRM1 P35372 3/20 0.56
▸ STAT6 P42226 1/20 0.53
▸ BDKRB2 P30411 1/20 0.52
▸ TACR1 P25103 1/20 0.51
▸ OPRD1 P41143 1/20 0.50
▸ NTSR2 O95665 1/20 0.50
▸ NTSR1 P30989 1/20 0.50
▸ SORT1 Q99523 1/20 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
SCHEMBL30443402 0.90 F2 (0.69) F2ACEOPRM1OPRD1
SCHEMBL29421094 0.90 F2 (0.69) F2ACEOPRM1OPRD1
SCHEMBL31114383 0.90 OPRM1 (0.68) F2OPRM1OPRD1NTSR2NTSR1
SCHEMBL31114474 0.89 F2 (0.53) F2ACEOPRM1NTSR2NTSR1
SCHEMBL29421086 0.88 F2 (0.66) F2ACEOPRM1OPRD1
SCHEMBL31679387 0.86 OPRM1 (0.66) F2OPRM1OPRD1
SCHEMBL30609950 0.86 F2 (0.67) F2ACEOPRM1OPRD1NTSR2
SCHEMBL29886812 0.85 F2 (0.55) F2ACEOPRM1NTSR2NTSR1
SCHEMBL31114332 0.85 OPRM1 (0.70) F2OPRM1OPRD1NTSR2NTSR1
SCHEMBL31114540 0.85 OPRM1 (0.64) F2OPRM1OPRD1NTSR2NTSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119798369-A Milk-derived small molecule peptide and application thereof 昆明理工大学 2025-04-11 — — CN claimed
CN-119798369-A Milk-derived small molecule peptide and application thereof 昆明理工大学 2025-04-11 — — CN disclosed
CN-119798369-A Milk-derived small molecule peptide and application thereof 昆明理工大学 2025-04-11 — — CN disclosed
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