SCHEMBL21392453

SCHEMBL21392453

CCCC[C@H](NC(C)=O)C(=O)NC1CCC(=O)NCCC(C(N)=O)NC(=O)CNC(=O)C(Cc2ccccc2Cl)NC(=O)CNC1=O

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 18/20 0.47
▸ MC3R P41968 15/20 0.44
▸ MC1R Q01726 15/20 0.44
▸ MC5R P33032 2/20 0.42

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
SCHEMBL21392389 0.87 MC4R (0.45) MC4RMC3RMC1R
SCHEMBL21392254 0.86 MC4R (0.46) MC4RMC3RMC1RMC5R
SCHEMBL12092637 0.83 MC4R (0.47) MC4RMC3RMC1RMC5R
SCHEMBL20206178 0.83 SIRT2 (0.40) —
SCHEMBL21392400 0.81 MC4R (0.53) MC4RMC1R
SCHEMBL21392454 0.81 MC4R (0.52) MC4RMC3RMC1RMC5R
SCHEMBL21392471 0.81 MC4R (0.50) MC4RMC3RMC1RMC5R
SCHEMBL21392357 0.78 MC4R (0.68) MC4RMC3RMC1RMC5R
SCHEMBL21392372 0.78 MC4R (0.49) MC4RMC3RMC1RMC5R
SCHEMBL21392287 0.77 MC4R (0.47) MC4RMC3RMC1RMC5R

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-2019183472-A1 MELANOCORTIN RECEPTOR-SPECIFIC PEPTIDE FORMULATIONS AND METHODS FOR GASTROINTESTINAL TRACT-SPECIFIC DELIVERY PALATIN TECHNOLOGIES, INC. (US) 2019-09-26 — — WO disclosed
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