SCHEMBL31688354

SCHEMBL31688354

CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 3/20 0.61
▸ OPRD1 P41143 3/20 0.61
▸ NPY2R P49146 6/20 0.61
▸ NPY4R P50391 6/20 0.61
▸ NPY5R Q15761 6/20 0.61
▸ NPY1R P25929 4/20 0.61
▸ CALCR P30988 4/20 0.60
▸ NTSR2 O95665 2/20 0.60
▸ SORT1 Q99523 2/20 0.60

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
SCHEMBL31683370 0.91 CALCR (0.70) NPY2RNPY4RNPY5RNPY1RCALCR
SCHEMBL30607403 0.91 CALCR (0.67) OPRD1NPY2RNPY4RNPY5RNPY1R
SCHEMBL30906432 0.90 NPY2R (0.64) NTSR1NPY2RNPY4RNPY5RNPY1R
SCHEMBL30906330 0.90 NPY2R (0.64) NTSR1NPY2RNPY4RNPY5RNPY1R
SCHEMBL30906423 0.90 NPY2R (0.64) NTSR1NPY2RNPY4RNPY5RNPY1R
SCHEMBL31683307 0.90 NPY2R (0.62) NTSR1OPRD1NPY2RNPY4RNPY5R
SCHEMBL29811064 0.89 CALCR (0.66) OPRD1NPY2RNPY4RNPY5RNPY1R
SCHEMBL30906360 0.89 NPY2R (0.62) NTSR1OPRD1NPY2RNPY4RNPY5R
SCHEMBL30429446 0.88 NPY2R (0.65) NTSR1OPRD1NPY2RNPY4RNPY5R
SCHEMBL29479889 0.88 NPY2R (0.67) NTSR1NPY2RNPY4RNPY5RNPY1R

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
US-20250297282-A1 VIRAL-BINDING PROTEIN AND RELATED REAGENTS, ARTICLES, AND METHODS OF USE JUNO THERAPEUTICS GMBH (DE) 2025-09-25 — — US disclosed
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