SCHEMBL29376509

SCHEMBL29376509

CC[C@H](C)[C@H](N)C(=O)N[C@@H](CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)OC)[C@@H](C)CC

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NPY1R P25929 4/20 0.83
▸ NPY2R P49146 1/20 0.83
▸ NPY4R P50391 1/20 0.83
▸ NPY5R Q15761 1/20 0.83
▸ NTSR1 P30989 9/20 0.71
▸ NTSR2 O95665 7/20 0.71
▸ SORT1 Q99523 4/20 0.65
▸ OPRD1 P41143 2/20 0.62
▸ OPRM1 P35372 1/20 0.62
▸ OPRK1 P41145 1/20 0.62
▸ NMUR2 Q9GZQ4 2/20 0.61
▸ NMUR1 Q9HB89 2/20 0.61

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
SCHEMBL30692366 1.00 NPY1R (0.83) NPY1RNPY2RNPY4RNPY5RNTSR1
SCHEMBL16489150 0.90 NPY1R (0.68) NPY1RNPY2RNPY4RNPY5RNTSR1
SCHEMBL10085999 0.90 NPY1R (0.68) NPY1RNPY2RNPY4RNPY5RNTSR1
SCHEMBL29973182 0.84 NPY1R (0.69) NPY1RNPY2RNPY4RNPY5RNTSR1
SCHEMBL30038638 0.84 NPY1R (0.69) NPY1RNPY2RNPY4RNPY5RNTSR1
SCHEMBL29930119 0.83 NTSR1 (0.87) NPY1RNTSR1NTSR2SORT1OPRD1
SCHEMBL29416842 0.83 NTSR1 (0.87) NTSR1NTSR2SORT1
SCHEMBL30472155 0.83 NTSR1 (0.87) NTSR1NTSR2SORT1
SCHEMBL29398203 0.83 NTSR1 (0.87) NTSR1NTSR2SORT1
SCHEMBL29519178 0.80 NMUR2 (0.79) NPY1RNTSR1NTSR2OPRD1OPRM1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250116662-A1 SYSTEM, DEVICE AND METHOD FOR HIGH-THROUGHPUT MULTI-PLEXED DETECTION YALE UNIVERSITY (US) 2025-04-10 — — US disclosed
US-12105086-B2 System, device and method for high-throughput multi-plexed detection YALE UNIVERSITY (US) 2024-10-01 — — US disclosed
EP-3739039-B1 METHODS AND COMPOSITIONS FOR MODULATING TH-GM CELL FUNCTION NAT UNIV SINGAPORE (SG) 2024-08-28 — — EP disclosed
EP-3198007-B1 METHODS AND COMPOSITIONS FOR MODULATING TH-GM CELL FUNCTION NAT UNIV SINGAPORE (SG) 2023-11-01 — — EP disclosed
EP-4148118-A1 SYSTEM, DEVICE AND METHOD FOR HIGH-THROUGHPUT MULTI-PLEXED DETECTION Yale University (US) 2023-03-15 — — EP disclosed
EP-2888349-B1 SYSTEM, DEVICE AND METHOD FOR HIGH-THROUGHPUT MULTI-PLEXED DETECTION UNIV YALE (US) 2022-02-09 — — EP disclosed
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