SCHEMBL30726588

SCHEMBL30726588

CC(C)[C@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)O)[C@@H](C)O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 9/20 0.63
▸ CCKBR P32239 4/20 0.63
▸ C5AR1 P21730 2/20 0.63
▸ NMBR P28336 2/20 0.62
▸ GRPR P30550 2/20 0.62
▸ GCGR P47871 3/20 0.59
▸ CALCR P30988 4/20 0.58
▸ NPY1R P25929 1/20 0.58
▸ NPY2R P49146 1/20 0.58
▸ NPY4R P50391 1/20 0.58
▸ NPY5R Q15761 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
SCHEMBL30432529 0.90 C5AR1 (0.67) GLP1RCCKBRC5AR1NMBRGRPR
SCHEMBL31000951 0.90 C5AR1 (0.71) GLP1RCCKBRC5AR1NMBRGRPR
SCHEMBL30537029 0.89 GLP1R (0.72) GLP1RCCKBRC5AR1CALCRNPY1R
SCHEMBL30436196 0.89 NPY1R (0.67) GLP1RCCKBRC5AR1GCGRCALCR
SCHEMBL31000923 0.89 GLP1R (0.68) GLP1RCCKBRNMBRGRPRCALCR
SCHEMBL30648477 0.89 GLP1R (0.67) GLP1RCCKBRC5AR1NMBRGRPR
SCHEMBL31000945 0.88 C5AR1 (0.73) GLP1RCCKBRC5AR1GCGRNPY1R
SCHEMBL31105353 0.88 GLP1R (0.70) GLP1RCCKBRC5AR1CALCRNPY1R
SCHEMBL29945131 0.87 NMBR (0.62) GLP1RCCKBRC5AR1NMBRGRPR
SCHEMBL31105456 0.87 NPY2R (0.71) GLP1RC5AR1GCGRNPY1RNPY2R

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
WO-2024020063-A2 ANTI-HRF ANTIBODIES LA JOLLA INSTITUTE FOR IMMUNOLOGY (US) 2024-01-25 — — WO disclosed
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