SCHEMBL31689355

SCHEMBL31689355

CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 15/20 0.65
▸ C5AR1 P21730 1/20 0.61
▸ GLP1R P43220 3/20 0.60
▸ IL23R Q5VWK5 1/20 0.58

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
SCHEMBL29449893 0.95 NPBWR1 (0.61) NPBWR1C5AR1GLP1RIL23R
SCHEMBL31439367 0.93 NPBWR1 (0.65) NPBWR1C5AR1IL23R
SCHEMBL29461975 0.93 C5AR1 (0.62) NPBWR1C5AR1IL23R
SCHEMBL30518069 0.93 C5AR1 (0.59) NPBWR1C5AR1
SCHEMBL31439394 0.93 NPBWR1 (0.62) NPBWR1C5AR1IL23R
SCHEMBL29419495 0.92 C5AR1 (0.59) NPBWR1C5AR1GLP1RIL23R
SCHEMBL29700350 0.92 IL23R (0.66) NPBWR1GLP1RIL23R
SCHEMBL30518038 0.91 NPBWR1 (0.61) NPBWR1C5AR1GLP1RIL23R
SCHEMBL29461985 0.91 TUBB4A (0.58) NPBWR1C5AR1IL23R
SCHEMBL29461969 0.90 C5AR1 (0.61) NPBWR1C5AR1GLP1RIL23R

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-120699102-A Construction and activity evaluation of antibacterial peptide inhibitor GLIP16 specifically identified and combined with BamA 滨州医学院 2025-09-26 — — CN disclosed
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