SCHEMBL30607337

SCHEMBL30607337

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)C(C)C

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 1/20 0.66
▸ NPY2R P49146 1/20 0.66
▸ NPY4R P50391 1/20 0.66
▸ NPY5R Q15761 1/20 0.66
▸ C5AR1 P21730 1/20 0.63
▸ GLP1R P43220 15/20 0.62
▸ GCGR P47871 3/20 0.60
▸ CCKBR P32239 2/20 0.59
▸ CALCR P30988 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
SCHEMBL31182592 0.93 C5AR1 (0.68) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29625335 0.92 NPY1R (0.69) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31182590 0.91 GLP1R (0.68) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29965312 0.91 NPY1R (0.68) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31402803 0.90 GLP1R (0.69) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31547374 0.90 GLP1R (0.70) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31547375 0.90 NPY2R (0.71) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL29742994 0.89 C5AR1 (0.73) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31182586 0.89 GLP1R (0.70) NPY1RNPY2RNPY4RNPY5RC5AR1
SCHEMBL31182774 0.89 GLP1R (0.65) NPY1RNPY2RNPY4RNPY5RC5AR1

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
US-12383505-B2 Nanoparticle for the remodeling of cancer-associated fibroblasts UNIVERSITY OF SOUTH CAROLINA (US) 2025-08-12 — — US disclosed
US-20230310331-A1 NANOPARTICLE FOR THE REMODELING OF CANCER-ASSOCIATED FIBROBLASTS UNIVERSITY OF SOUTH CAROLINA (US) 2023-10-05 — — US disclosed
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