SCHEMBL30883233

SCHEMBL30883233

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(N)=O)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NMUR2 Q9GZQ4 5/20 0.68
NMUR1 Q9HB89 5/20 0.68
NPY2R P49146 7/20 0.65
NPY4R P50391 7/20 0.65
NPY5R Q15761 7/20 0.65
NPY1R P25929 5/20 0.65
EP300 Q09472 1/20 0.65
HIF1A Q16665 1/20 0.65
F2 P00734 4/20 0.64
TFPI P10646 2/20 0.63

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
SCHEMBL30607415 0.92 EP300 (0.67) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL30883234 0.91 NPY2R (0.65) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL30883213 0.90 NMUR2 (0.64) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31183026 0.90 NPY2R (0.64) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL30712950 0.90 MAPK8 (0.67) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31182912 0.90 NPY2R (0.66) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL31182662 0.90 NPY2R (0.68) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL30433571 0.90 NPY2R (0.69) NMUR2NMUR1NPY2RNPY4RNPY5R
SCHEMBL30432109 0.90 CALCR (0.69) NPY2RNPY4RNPY5RNPY1RF2
SCHEMBL30262198 0.89 EP300 (0.64) NMUR2NMUR1NPY2RNPY4RNPY5R

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
US-20240150800-A1 RECOMBINANT ALGAE HAVING HIGH BIOMASS AND LIPID PRODUCTIVITY PHYKION INC. 2024-05-09 US disclosed