SCHEMBL29777729

SCHEMBL29777729

C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 10/20 0.48
▸ ACE P12821 2/20 0.44
▸ OPRM1 P35372 1/20 0.42
▸ F2 P00734 1/20 0.42
▸ GRB2 P62993 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
SCHEMBL29801982 0.95 REN (0.48) RENACEF2
SCHEMBL30731556 0.92 REN (0.48) RENACEOPRM1F2
SCHEMBL30844404 0.90 REN (0.47) RENF2GRB2
SCHEMBL32681290 0.90 OPRM1 (0.48) RENACEOPRM1F2
SCHEMBL29801948 0.88 REN (0.47) RENACE
SCHEMBL30844403 0.88 REN (0.49) RENF2GRB2
SCHEMBL29802035 0.88 ACE (0.49) RENACE
SCHEMBL31031472 0.87 MAPK8 (0.47) RENOPRM1GRB2
SCHEMBL30284914 0.86 ACE (0.48) RENACE
SCHEMBL29962469 0.86 REN (0.44) RENACEOPRM1F2

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-114989313-A P-tau181 epitope peptide and application thereof in Alzheimer disease detection 亿彤科技发展(福建)有限公司 2022-09-02 — — CN disclosed
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