SCHEMBL29547718

SCHEMBL29547718

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 11/20 0.50
▸ NTSR2 O95665 4/20 0.47
▸ NTSR1 P30989 3/20 0.46
▸ SORT1 Q99523 2/20 0.43
▸ APLNR P35414 2/20 0.42
▸ MC4R P32245 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
SCHEMBL29591797 0.87 REN (0.43) RENNTSR2
SCHEMBL29630400 0.86 REN (0.44) RENNTSR2
SCHEMBL29630460 0.86 TRHR (0.39) REN
SCHEMBL38666572 0.86 REN (0.46) RENNTSR2NTSR1
SCHEMBL29630379 0.84 REN (0.39) REN
SCHEMBL30997447 0.84 TRHR (0.40) REN
SCHEMBL29644734 0.84 REN (0.47) RENNTSR2
SCHEMBL14482776 0.84 REN (0.42) RENNTSR2APLNR
SCHEMBL29547187 0.84 NTSR2 (0.48) NTSR2NTSR1APLNRMC4R
SCHEMBL29461669 0.84 NTSR2 (0.48) NTSR2NTSR1APLNRMC4R

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
CN-111909238-B High-zinc-chelation-activity zinc chelating peptide containing Ser-Cys and application thereof 安徽省农业科学院农产品加工研究所 2022-04-08 — — CN disclosed
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