SCHEMBL30607423

SCHEMBL30607423

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

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 8/20 0.69
▸ NPY4R P50391 8/20 0.69
▸ NPY5R Q15761 8/20 0.69
▸ NPY1R P25929 6/20 0.69
▸ KISS1R Q969F8 4/20 0.63
▸ KEAP1 Q14145 1/20 0.60
▸ GLP1R P43220 4/20 0.59
▸ CXCR4 P61073 1/20 0.57

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
SCHEMBL38654334 0.89 NPY2R (0.70) NPY2RNPY4RNPY5RNPY1RKEAP1
SCHEMBL29552852 0.89 KISS1R (0.68) NPY2RNPY4RNPY5RNPY1RKISS1R
SCHEMBL30658333 0.89 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RKEAP1
SCHEMBL30786585 0.88 KISS1R (0.68) NPY2RNPY4RNPY5RNPY1RKISS1R
SCHEMBL30607480 0.88 NPY1R (0.61) NPY2RNPY4RNPY5RNPY1RKISS1R
SCHEMBL29351200 0.88 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RKISS1R
SCHEMBL29578881 0.88 NPY2R (0.73) NPY2RNPY4RNPY5RNPY1RKISS1R
SCHEMBL30576989 0.87 NPY2R (0.67) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31000928 0.87 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30256968 0.87 NPY1R (0.66) NPY2RNPY4RNPY5RNPY1RKISS1R

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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