SCHEMBL21529635

SCHEMBL21529635

CC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NC(Cc1ccc(O)cc1)C(=O)NC(CC(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NTSR2 O95665 14/20 0.59
SLC6A2 P23975 1/20 0.57
NTSR1 P30989 13/20 0.54
SORT1 Q99523 11/20 0.54
PSMB9 P28065 1/20 0.52

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
SCHEMBL21529632 1.00 NTSR2 (0.59) NTSR2SLC6A2NTSR1SORT1PSMB9
SCHEMBL21529634 1.00 NTSR2 (0.59) NTSR2SLC6A2NTSR1SORT1PSMB9
SCHEMBL29830804 0.89 SLC6A2 (0.63) NTSR2SLC6A2NTSR1SORT1PSMB9
SCHEMBL30249139 0.89 NTSR2 (0.61) NTSR2SLC6A2NTSR1SORT1
SCHEMBL26287466 0.88 SLC6A2 (0.52) NTSR2SLC6A2NTSR1SORT1
SCHEMBL29673326 0.87 NTSR2 (0.63) NTSR2SLC6A2NTSR1SORT1
SCHEMBL31059337 0.86 SLC6A2 (0.59) SLC6A2
SCHEMBL31612357 0.85 SLC6A2 (0.73) NTSR2SLC6A2NTSR1SORT1
SCHEMBL30060726 0.85 OPRM1 (0.69) SLC6A2
SCHEMBL31406966 0.84 SLC6A2 (0.72) NTSR2SLC6A2NTSR1SORT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240041743-A1 SYNERGISTIC TETRAPEPTIDE COMBINATION BASF BEAUTY CARE SOLUTIONS FRANCE S.A.S. (FR) 2024-02-08 US claimed
US-20190336429-A1 SYNERGISTIC TETRAPEPTIDE COMBINATION BASF CORPORATION 2019-11-07 US claimed
US-20240041743-A1 SYNERGISTIC TETRAPEPTIDE COMBINATION BASF BEAUTY CARE SOLUTIONS FRANCE S.A.S. (FR) 2024-02-08 US disclosed
US-20190336429-A1 SYNERGISTIC TETRAPEPTIDE COMBINATION BASF CORPORATION 2019-11-07 US disclosed