SCHEMBL30838788

SCHEMBL30838788

C[C@H](N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 2/20 0.61
▸ ECE1 P42892 12/20 0.58
▸ ERAP2 Q6P179 1/20 0.55

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
SCHEMBL31256996 0.96 ERAP2 (0.62) ACEECE1ERAP2
SCHEMBL31073596 0.93 ACE (0.59) ACEECE1ERAP2
SCHEMBL29750395 0.93 ACE (0.59) ACEECE1ERAP2
SCHEMBL29453409 0.92 GHSR (0.63) ACEECE1ERAP2
SCHEMBL31259938 0.92 ACE (0.57) ACEECE1
SCHEMBL31259937 0.92 ACE (0.57) ACEECE1
SCHEMBL31259935 0.92 ACE (0.57) ACEECE1
SCHEMBL31259936 0.92 ACE (0.57) ACEECE1
SCHEMBL31259940 0.92 ACE (0.57) ACEECE1
SCHEMBL30628999 0.92 ACE (0.57) ACEECE1

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-118001175-A Short peptide synergistic and arbutin synergistic whitening composition and application thereof 上海应用技术大学 2024-05-10 — — CN claimed
CN-118001175-A Short peptide synergistic and arbutin synergistic whitening composition and application thereof 上海应用技术大学 2024-05-10 — — CN disclosed
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