SCHEMBL29644734

SCHEMBL29644734

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

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 17/20 0.47
▸ NTSR2 O95665 1/20 0.43

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
SCHEMBL38666572 0.99 REN (0.46) RENNTSR2
SCHEMBL29630400 0.88 REN (0.44) RENNTSR2
SCHEMBL29591797 0.87 REN (0.43) RENNTSR2
SCHEMBL30997447 0.85 TRHR (0.40) REN
SCHEMBL29547718 0.84 REN (0.50) RENNTSR2
SCHEMBL29630460 0.83 TRHR (0.39) REN
SCHEMBL31483268 0.83 REN (0.48) REN
SCHEMBL29614861 0.83 CALCRL (0.46) REN
SCHEMBL29531185 0.82 REN (0.42) RENNTSR2
SCHEMBL10655673 0.82 REN (0.61) REN

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-110669122-B Preparation method of zein anti-inflammatory polypeptide 江苏大学 2022-06-21 — — CN disclosed
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