SCHEMBL31683307

SCHEMBL31683307

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

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 7/20 0.62
▸ NPY4R P50391 7/20 0.62
▸ NPY5R Q15761 7/20 0.62
▸ NPY1R P25929 5/20 0.62
▸ NTSR1 P30989 3/20 0.61
▸ OPRD1 P41143 1/20 0.61
▸ CALCR P30988 4/20 0.60
▸ NTSR2 O95665 1/20 0.59
▸ SORT1 Q99523 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
SCHEMBL29811064 0.92 CALCR (0.66) NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL30906423 0.91 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL30906432 0.91 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL30906330 0.91 NPY2R (0.64) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL29679500 0.91 CALCR (0.64) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL31688354 0.90 NTSR1 (0.61) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL29558121 0.90 OPRD1 (0.65) NPY1RNTSR1OPRD1NTSR2SORT1
SCHEMBL30607403 0.90 CALCR (0.67) NPY2RNPY4RNPY5RNPY1ROPRD1
SCHEMBL29479848 0.89 F2 (0.63) NPY2RNPY4RNPY5RNPY1RNTSR1
SCHEMBL31182523 0.89 NPY2R (0.65) NPY2RNPY4RNPY5RNPY1RCALCR

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-20250283037-A1 METHODS FOR STIMULATING AND TRANSDUCING T CELLS JUNO THERAPEUTICS GMBH (DE) 2025-09-11 — — US disclosed
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