SCHEMBL30712850

SCHEMBL30712850

CC(=O)N[C@H](Cc1ccc(I)cc1)C(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.50
MC4R P32245 4/20 0.49
NPY4R P50391 7/20 0.47
NPY5R Q15761 6/20 0.47
NPY1R P25929 5/20 0.47
NPY2R P49146 3/20 0.47
MME P08473 2/20 0.47
ACE P12821 2/20 0.47
CPA1 P15085 2/20 0.47
ACE2 Q9BYF1 2/20 0.47
FOLH1 Q04609 4/20 0.46

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
SCHEMBL29572744 1.00 GNPAT (0.50) GNPATMC4RNPY4RNPY5RNPY1R
SCHEMBL30712847 1.00 GNPAT (0.50) GNPATMC4RNPY4RNPY5RNPY1R
SCHEMBL30712846 1.00 GNPAT (0.50) GNPATMC4RNPY4RNPY5RNPY1R
SCHEMBL30712856 0.97 GNPAT (0.49) GNPATMC4RNPY4RNPY5RNPY1R
SCHEMBL19656447 0.94 NPY4R (0.54) MC4RNPY4RNPY5RNPY1RNPY2R
SCHEMBL30712842 0.93 GNPAT (0.52) GNPATMC4RMMEACECPA1
SCHEMBL30029024 0.92 GNPAT (0.56) GNPATMC4RNPY4RNPY5RNPY1R
SCHEMBL29968334 0.90 ALB (0.53) GNPATNPY4RNPY5RNPY1RNPY2R
SCHEMBL6551485 0.90 MC4R (0.57) MC4RNPY4RNPY5RNPY1RNPY2R
SCHEMBL6552855 0.90 MC4R (0.57) MC4RNPY4RNPY5RNPY1RNPY2R

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
US-20240002438-A1 MELANOCORTIN LIGANDS AND METHODS OF USE THEREOF THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES 2024-01-04 US claimed
US-20240002438-A1 MELANOCORTIN LIGANDS AND METHODS OF USE THEREOF THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES 2024-01-04 US disclosed