SCHEMBL31301806

SCHEMBL31301806

N=C(N)NCCC[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)NCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 14/20 0.54
▸ NPY1R P25929 8/20 0.54
▸ NPY5R Q15761 6/20 0.54
▸ NPY2R P49146 5/20 0.54
▸ TFPI P10646 1/20 0.52
▸ OPRM1 P35372 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ OPRK1 P41145 1/20 0.48

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
SCHEMBL30354440 0.94 NPY4R (0.57) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31013834 0.94 NPY4R (0.57) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30562995 0.92 TFPI (0.55) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30350874 0.92 TFPI (0.55) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30516186 0.91 TFPI (0.55) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31301705 0.90 TFPI (0.58) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31121317 0.90 TFPI (0.60) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL31256982 0.90 NPY4R (0.60) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL29591879 0.89 TFPI (0.55) NPY4RNPY1RNPY5RNPY2RTFPI
SCHEMBL30525408 0.89 NPY4R (0.54) NPY4RNPY1RNPY5RNPY2ROPRM1

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-119390854-A Polypeptide Tat-CIRP and application thereof 南通大学 2025-02-07 — — CN disclosed
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