SCHEMBL30716920

SCHEMBL30716920

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 1/20 0.52
▸ NOD1 Q9Y239 6/20 0.47
▸ SLC15A2 Q16348 1/20 0.47
▸ ITGB3 P05106 1/20 0.47
▸ ITGA2B P08514 1/20 0.47
▸ FOLH1 Q04609 2/20 0.43
▸ TLR2 O60603 1/20 0.42
▸ GLP1R P43220 6/20 0.41
▸ NMT2 O60551 1/20 0.41
▸ NMT1 P30419 1/20 0.41
▸ APLNR P35414 1/20 0.40

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
SCHEMBL29941942 0.93 SLC6A5 (0.52) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL29942005 0.92 SLC6A5 (0.51) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL30562642 0.91 SLC6A5 (0.52) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL31265389 0.91 SLC15A2 (0.51) SLC6A5SLC15A2FOLH1
SCHEMBL322731 0.90 SLC6A5 (0.52) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL1163474 0.90 SLC6A5 (0.52) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL31139543 0.89 SLC15A2 (0.58) SLC6A5SLC15A2ITGB3ITGA2BFOLH1
SCHEMBL31138844 0.89 SLC6A5 (0.50) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL29467847 0.88 SLC6A5 (0.49) SLC6A5NOD1SLC15A2ITGB3ITGA2B
SCHEMBL2150241 0.87 GART (0.42) SLC6A5NOD1SLC15A2FOLH1

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-20240009105-A1 TETRAPEPTIDE AND COMPOSITIONS COMPRISING TETRAPEPTIDES THE BOOTS COMPANY PLC (GB) 2024-01-11 — — US disclosed
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