SCHEMBL31000908

SCHEMBL31000908

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1)[C@@H](C)O)C(C)C)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCC(=O)O)C(=O)O)C(C)C

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NPY2R P49146 5/20 0.72
▸ NPY4R P50391 5/20 0.72
▸ NPY5R Q15761 5/20 0.72
▸ NPY1R P25929 4/20 0.72
▸ MAPK8 P45983 1/20 0.68
▸ MAPK9 P45984 1/20 0.68
▸ MAPK10 P53779 1/20 0.68
▸ GLP1R P43220 7/20 0.66
▸ CXCR4 P61073 4/20 0.65
▸ CCKBR P32239 2/20 0.65
▸ CALCR P30988 1/20 0.64

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
SCHEMBL30800086 0.95 NPY1R (0.70) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30800083 0.95 NPY1R (0.70) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30800085 0.94 NPY1R (0.71) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30800084 0.94 NPY1R (0.71) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30800087 0.94 NPY1R (0.71) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31000884 0.94 NPY2R (0.75) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL30658240 0.94 NPY2R (0.74) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL31073531 0.93 MAPK8 (0.66) NPY2RNPY4RNPY5RNPY1RMAPK8
SCHEMBL31402804 0.92 GLP1R (0.71) NPY2RNPY4RNPY5RNPY1RGLP1R
SCHEMBL29443917 0.92 CALCR (0.66) NPY2RNPY4RNPY5RNPY1RGLP1R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4630447-A2 ANTIBODIES OR FRAGMENTS THEREOF FOR SARS-COV-2 AND VARIANTS THEREOF Abwiz Bio, Inc. (US) 2025-10-15 — — EP disclosed
WO-2024124241-A2 ANTIBODIES OR FRAGMENTS THEREOF FOR SARS-COV-2 AND VARIANTS THEREOF ABWIZ BIO, INC. (US) 2024-06-13 — — WO disclosed
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