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SCHEMBL30469505

SCHEMBL30469505

CC(C)C[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)CC(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 1/20 0.58
▸ MMP1 P03956 3/20 0.55
▸ MMP2 P08253 3/20 0.55
▸ MMP8 P22894 2/20 0.55
▸ KISS1R Q969F8 15/20 0.55
▸ MMP9 P14780 1/20 0.53

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
SCHEMBL30544320 0.96 ERAP2 (0.61) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL31484225 0.95 ERAP2 (0.57) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL30469508 0.95 KISS1R (0.61) KISS1R
SCHEMBL30570473 0.94 ERAP2 (0.57) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL31484223 0.93 ERAP2 (0.51) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL29975915 0.93 KISS1R (0.57) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL30522762 0.92 ECE1 (0.58) ERAP2MMP1MMP2MMP8KISS1R
SCHEMBL31314991 0.92 KISS1R (0.61) ERAP2KISS1R
SCHEMBL31229004 0.92 ERAP2 (0.62) ERAP2KISS1R
SCHEMBL28664028 0.92 ECE1 (0.59) ERAP2KISS1R

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-116284239-A Preparation method of sturgeon ovary antioxidant peptide 江苏大学 2023-06-23 — — CN disclosed
CN-116284239-A Preparation method of sturgeon ovary antioxidant peptide 江苏大学 2023-06-23 — — CN disclosed
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