SCHEMBL30394925

SCHEMBL30394925

CC(C)C[C@H](NC(=O)CN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CCCCN)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC15A2 Q16348 1/20 0.55
▸ CPB2 Q96IY4 7/20 0.48
▸ FOLH1 Q04609 5/20 0.48
▸ ERAP2 Q6P179 1/20 0.47
▸ ERAP1 Q9NZ08 1/20 0.47
▸ LNPEP Q9UIQ6 1/20 0.47
▸ NMT2 O60551 1/20 0.47
▸ NMT1 P30419 1/20 0.47
▸ SLC6A5 Q9Y345 1/20 0.47
▸ NOD1 Q9Y239 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ OPRK1 P41145 1/20 0.41
▸ GRIN2D O15399 1/20 0.41
▸ GRIN3B O60391 1/20 0.41
▸ GRIN1 Q05586 1/20 0.41
▸ GRIN2A Q12879 1/20 0.41
▸ GRIN2B Q13224 1/20 0.41
▸ GRIN2C Q14957 1/20 0.41
▸ GRIN3A Q8TCU5 1/20 0.41

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
SCHEMBL29904373 1.00 SLC15A2 (0.55) SLC15A2CPB2FOLH1ERAP2ERAP1
SCHEMBL1371688 0.94 GNPAT (0.50) SLC15A2CPB2FOLH1ERAP2ERAP1
SCHEMBL28809596 0.94 GNPAT (0.50) SLC15A2CPB2FOLH1ERAP2ERAP1
SCHEMBL19918592 0.91 NMT2 (0.47) SLC15A2CPB2FOLH1ERAP2ERAP1
SCHEMBL31652408 0.90 SLC6A5 (0.46) SLC15A2CPB2FOLH1ERAP2ERAP1
SCHEMBL30964327 0.88 SLC15A2 (0.62) SLC15A2CPB2FOLH1NMT2NMT1
SCHEMBL30371073 0.88 SLC15A2 (0.62) SLC15A2CPB2FOLH1NMT2NMT1
SCHEMBL1711530 0.87 CPB2 (0.49) CPB2FOLH1ERAP2ERAP1LNPEP
SCHEMBL7205366 0.87 ALDH1A1 (0.58) CPB2FOLH1ERAP2ERAP1LNPEP
SCHEMBL8006925 0.87 CPB2 (0.49) SLC15A2CPB2FOLH1ERAP2ERAP1

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-110054664-B Side chain fatty acid modified antibacterial peptide analogue containing D-type amino acid and synthesis and application thereof 倪京满 2023-05-26 — — CN claimed
CN-110054664-B Side chain fatty acid modified antibacterial peptide analogue containing D-type amino acid and synthesis and application thereof 倪京满 2023-05-26 — — CN disclosed
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