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SCHEMBL29669608

SCHEMBL29669608

CC[C@@H](C)[C@@H](NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](C)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](N)Cc1c[nH]c2ccccc12)[C@H](C)CC)C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPBWR1 P48145 12/20 0.65
▸ RXFP1 Q9HBX9 1/20 0.65
▸ GLP1R P43220 5/20 0.63
▸ CCKBR P32239 1/20 0.63
▸ GCGR P47871 1/20 0.62
▸ GIPR P48546 1/20 0.62
▸ PTH1R Q03431 1/20 0.62
▸ ECE1 P42892 1/20 0.62
▸ MUS81 Q96NY9 1/20 0.62
▸ IL23R Q5VWK5 1/20 0.59

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
SCHEMBL29669568 0.98 NPBWR1 (0.66) NPBWR1RXFP1GLP1RCCKBRPTH1R
SCHEMBL29669735 0.98 RXFP1 (0.64) NPBWR1RXFP1GLP1RCCKBRGCGR
SCHEMBL30773786 0.97 NPBWR1 (0.68) NPBWR1RXFP1GLP1RCCKBRPTH1R
SCHEMBL29669730 0.95 NPBWR1 (0.64) NPBWR1RXFP1GLP1RCCKBRGCGR
SCHEMBL30773852 0.95 NPBWR1 (0.69) NPBWR1RXFP1GLP1RCCKBRPTH1R
SCHEMBL29669569 0.94 NPBWR1 (0.66) NPBWR1RXFP1GLP1RCCKBRPTH1R
SCHEMBL29669637 0.92 NPBWR1 (0.71) NPBWR1
SCHEMBL31182496 0.92 GLP1R (0.68) RXFP1GLP1RCCKBRGCGRGIPR
SCHEMBL30773849 0.92 NPBWR1 (0.67) NPBWR1RXFP1GLP1RCCKBRGCGR
SCHEMBL30130548 0.91 NPBWR1 (0.67) NPBWR1

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-114641486-A For reducing CB1Peptide compounds of side effects of receptor agonists 庞培法布拉大学 2022-06-17 — — CN claimed
CN-114641486-B For reducing CB1Peptide compounds for side effects of receptor agonists 庞培法布拉大学 2025-04-01 — — CN disclosed
CN-114641486-A For reducing CB1Peptide compounds of side effects of receptor agonists 庞培法布拉大学 2022-06-17 — — CN disclosed
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