SCHEMBL29995282

SCHEMBL29995282

CC[C@H](C)[C@H](N)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O)[C@@H](C)O

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 15/20 0.45
▸ NPY1R P25929 9/20 0.45
▸ NPY5R Q15761 8/20 0.45
▸ NPY2R P49146 5/20 0.45

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
SCHEMBL30085019 0.94 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30239619 0.93 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29430145 0.92 NPY4R (0.45) NPY4RNPY1RNPY5RNPY2R
SCHEMBL29777419 0.89 ENPEP (0.48) —
SCHEMBL31277463 0.88 ENPEP (0.46) —
SCHEMBL30303032 0.88 ENPEP (0.46) —
SCHEMBL30111320 0.87 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL13723928 0.86 KISS1R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL16357955 0.86 KISS1R (0.43) NPY4RNPY1RNPY5RNPY2R
SCHEMBL30988493 0.86 NPY4R (0.43) NPY4RNPY1RNPY5RNPY2R

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
EP-4096670-A1 LIGAND-MEDIATED DELIVERY OF THERAPEUTIC PROTEINS AND THE USES THEREOF Purdue Research Foundation (US) 2022-12-07 — — EP claimed
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