SCHEMBL8929340

SCHEMBL8929340

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.77
NOD1 Q9Y239 11/20 0.68
NMT2 O60551 2/20 0.58
NMT1 P30419 2/20 0.58
TLR2 O60603 1/20 0.58
ITGB3 P05106 1/20 0.54
ITGA2B P08514 1/20 0.54
SIRT6 Q8N6T7 1/20 0.53
SIRT1 Q96EB6 1/20 0.53
CTSL P07711 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
SCHEMBL29111716 1.00 SLC6A5 (0.77) SLC6A5NOD1NMT2NMT1TLR2
SCHEMBL2868427 0.95 SLC6A5 (0.70) SLC6A5NOD1NMT2NMT1TLR2
SCHEMBL28785969 0.95 SLC6A5 (0.70) SLC6A5NOD1NMT2NMT1TLR2
SCHEMBL1245563 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL1487710 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL9716739 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL9716727 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL342965 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL15474 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B
SCHEMBL1982744 0.94 SLC6A5 (0.85) SLC6A5NOD1ITGB3ITGA2B

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
CN-116919843-A A composition for skin anti-aging 北京理智之美科技有限公司 2023-10-24 CN disclosed
EP-0775751-A2 Cell transfection F. HOFFMANN-LA ROCHE AG (CH) 1997-05-28 EP disclosed