SCHEMBL31373856

SCHEMBL31373856

CC(C)C[C@H](N)C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 4/20 0.56
▸ NTSR1 P30989 2/20 0.52
▸ SLC6A2 P23975 1/20 0.52
▸ C5AR1 P21730 2/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ OPRD1 P41143 1/20 0.51
▸ REN P00797 1/20 0.51
▸ NTSR2 O95665 1/20 0.50
▸ MC4R P32245 1/20 0.50
▸ APLNR P35414 2/20 0.50
▸ NMUR2 Q9GZQ4 2/20 0.50
▸ NMUR1 Q9HB89 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
SCHEMBL30422183 0.90 F2 (0.45) F2NTSR1SLC6A2RENNTSR2
SCHEMBL31665963 0.89 REN (0.53) F2NTSR1SLC6A2OPRM1OPRD1
SCHEMBL30495776 0.89 F2 (0.59) F2SLC6A2C5AR1OPRM1OPRD1
SCHEMBL29591954 0.88 SLC6A2 (0.57) F2SLC6A2C5AR1OPRM1OPRD1
SCHEMBL30997464 0.88 F2 (0.60) F2NTSR1C5AR1REN
SCHEMBL30234221 0.86 NTSR2 (0.54) NTSR1SLC6A2OPRM1OPRD1NTSR2
SCHEMBL30422302 0.85 F2 (0.53) F2RENAPLNRNMUR2NMUR1
SCHEMBL29878778 0.85 F2 (0.55) F2RENMC4RAPLNRNMUR2
SCHEMBL32665685 0.85 F2 (0.52) F2SLC6A2OPRM1OPRD1NMUR2
SCHEMBL32691827 0.85 OPRM1 (0.55) F2SLC6A2C5AR1OPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119684400-A Red rice bran source small molecule peptide and application thereof 昆明理工大学 2025-03-25 — — CN disclosed
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