SCHEMBL31467768

SCHEMBL31467768

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(N)=O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CXCR4 P61073 5/20 0.55
▸ NPY2R P49146 7/20 0.54
▸ NPY4R P50391 7/20 0.54
▸ NPY5R Q15761 7/20 0.54
▸ NPY1R P25929 5/20 0.54
▸ TFPI P10646 4/20 0.53
▸ EPHA2 P29317 1/20 0.52
▸ OPRM1 P35372 2/20 0.50
▸ OPRK1 P41145 2/20 0.50

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
SCHEMBL31467766 0.97 NPY2R (0.54) CXCR4NPY2RNPY4RNPY5RNPY1R
SCHEMBL31437179 0.95 TFPI (0.56) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30562225 0.92 NPY2R (0.56) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31437214 0.92 NPY2R (0.56) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL31437159 0.91 CXCR4 (0.54) CXCR4NPY2RNPY4RNPY5RNPY1R
SCHEMBL31467754 0.88 KDM1A (0.59) CXCR4NPY2RNPY4RNPY5RNPY1R
SCHEMBL30522715 0.86 CXCR4 (0.50) CXCR4NPY2RNPY4RNPY5RNPY1R
Bpc-157 SCHEMBL30880330 0.86 NPY2R (0.48) NPY2RNPY4RNPY5RNPY1RTFPI
Bpc-157 SCHEMBL29406057 0.86 NPY2R (0.48) NPY2RNPY4RNPY5RNPY1RTFPI
SCHEMBL30280323 0.85 NPY2R (0.58) CXCR4NPY2RNPY4RNPY5RNPY1R

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
WO-2025037992-A1 NEW PEPTIDES AND USE THEREOF MAJEWSKI FILIP (PL) 2025-02-20 — — WO disclosed
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