SCHEMBL30607323

SCHEMBL30607323

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCSC)NC(=O)[C@@H](NC(=O)[C@@H](N)CC(=O)O)[C@@H](C)O)C(C)C)[C@@H](C)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)C(C)C)[C@@H](C)O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 12/20 0.64
▸ NPY1R P25929 1/20 0.62
▸ NPY2R P49146 1/20 0.62
▸ NPY4R P50391 1/20 0.62
▸ NPY5R Q15761 1/20 0.62
▸ GCGR P47871 8/20 0.62
▸ GIPR P48546 5/20 0.62
▸ KEAP1 Q14145 2/20 0.60
▸ PTH1R Q03431 3/20 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
SCHEMBL30658243 0.90 GLP1R (0.69) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL29415999 0.89 NPY1R (0.59) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL29743005 0.89 KEAP1 (0.62) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30768184 0.89 KISS1R (0.63) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30045080 0.88 GLP1R (0.79) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30536327 0.88 NPY2R (0.72) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL29429573 0.88 GLP1R (0.71) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL30658318 0.88 CXCR4 (0.68) GLP1RNPY1RNPY2RNPY4RNPY5R
SCHEMBL29376189 0.87 GLP1R (0.76) GLP1RGCGRGIPRPTH1R
SCHEMBL31182652 0.87 NPY1R (0.65) GLP1RNPY1RNPY2RNPY4RNPY5R

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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