SCHEMBL31453802

SCHEMBL31453802

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

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 15/20 0.72
ECE1 P42892 1/20 0.72
MUS81 Q96NY9 1/20 0.72
RXFP1 Q9HBX9 1/20 0.69
CCKBR P32239 1/20 0.67
NPBWR1 P48145 2/20 0.65
IL23R Q5VWK5 1/20 0.65
PTH1R Q03431 1/20 0.65

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
SCHEMBL30272000 1.00 GLP1R (0.72) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL30635326 0.96 RXFP1 (0.70) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL30183270 0.96 RXFP1 (0.70) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL29462132 0.96 RXFP1 (0.70) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL29693515 0.95 GLP1R (0.72) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL31453813 0.95 RXFP1 (0.70) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL31087271 0.94 RXFP1 (0.68) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL30271994 0.94 RXFP1 (0.68) GLP1RECE1MUS81RXFP1CCKBR
SCHEMBL30272003 0.94 RXFP1 (0.71) GLP1RECE1MUS81RXFP1NPBWR1
SCHEMBL29454666 0.94 GLP1R (0.75) GLP1RECE1MUS81RXFP1CCKBR

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-2025032025-A1 STABLE GLASSY MATERIAL BASED ON HISTIDINE, ARGININE AND GLUTAMIC ACID AMINO ACIDS VITROPEP (FR) 2025-02-13 WO disclosed