SCHEMBL31058456

SCHEMBL31058456

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCC(=O)O)C(C)C)C(=O)N[C@@H](CCC(=O)O)C(=O)NCC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.56
▸ GLP1R P43220 17/20 0.55
▸ GIPR P48546 17/20 0.55

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
SCHEMBL31058453 0.97 GLP1R (0.55) C5AR1GLP1RGIPR
SCHEMBL30665211 0.93 C5AR1 (0.59) C5AR1GLP1RGIPR
SCHEMBL30523243 0.92 CXCR4 (0.54) GLP1RGIPR
SCHEMBL31058451 0.91 CXCR4 (0.52) GLP1RGIPR
SCHEMBL29763090 0.91 GLP1R (0.61) C5AR1GLP1RGIPR
SCHEMBL29762984 0.91 GLP1R (0.61) C5AR1GLP1RGIPR
SCHEMBL31119468 0.90 C5AR1 (0.56) C5AR1GLP1RGIPR
SCHEMBL31119461 0.90 C5AR1 (0.56) C5AR1GLP1RGIPR
SCHEMBL30490787 0.89 CALCA (0.57) GLP1RGIPR
SCHEMBL30647309 0.88 GLP1R (0.66) GLP1RGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4421087-A1 STAPLE-CONTAINING POLYPEPTIDES AND APPLICATION THEREOF Soter Biopharma Pte. Ltd. (SG) 2024-08-28 — — EP claimed
EP-4421087-A1 STAPLE-CONTAINING POLYPEPTIDES AND APPLICATION THEREOF Soter Biopharma Pte. Ltd. (SG) 2024-08-28 — — EP disclosed
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