SCHEMBL30966840

SCHEMBL30966840

CC(C)C[C@H](NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 17/20 0.54
▸ NPY1R P25929 11/20 0.54
▸ NPY5R Q15761 9/20 0.54
▸ NPY2R P49146 7/20 0.54
▸ APLNR P35414 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
SCHEMBL29376654 0.97 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RAPLNR
SCHEMBL31064805 0.96 NPY4R (0.50) NPY4RNPY1RNPY5RNPY2RAPLNR
SCHEMBL30873807 0.94 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30515238 0.94 NPY4R (0.51) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30543172 0.92 NPY4R (0.47) NPY4RNPY1RNPY5RNPY2RAPLNR
SCHEMBL30062696 0.92 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2RAPLNR
SCHEMBL29808185 0.92 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29777920 0.92 NPY4R (0.48) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29376517 0.91 NPY4R (0.64) NPY4RNPY1RNPY5RNPY2R
SCHEMBL17887897 0.91 NPY4R (0.61) NPY4RNPY1RNPY5RNPY2RAPLNR

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-118184743-A Cell membrane penetrating agent derived from marine animals and application thereof 厦门大学 2024-06-14 — — CN disclosed
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