Sugi Predict

Sugi Predict / Compounds / SCHEMBL21392336

SCHEMBL21392336

SCHEMBL21392336

CCCC[C@H](NC(C)=O)C(=O)NC1CCC(=O)NCCC(C(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)NC)NC(=O)CNC(=O)C(Cc2ccccc2)NC(=O)CNC1=O

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MC4R P32245 15/20 0.61
▸ MC1R Q01726 13/20 0.61
▸ MC3R P41968 6/20 0.48
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ MC5R P33032 4/20 0.48

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
SCHEMBL21392357 0.94 MC4R (0.68) MC4RMC1RMC3RMEN1KMT2A
SCHEMBL12092514 0.88 MC4R (0.62) MC4RMC1RMC3RMC5R
SCHEMBL21392331 0.88 MC4R (0.62) MC4RMC1RMC3RMC5R
SCHEMBL20362937 0.87 MC4R (0.68) MC4RMC1RMC3RMC5R
SCHEMBL12657707 0.87 MC4R (0.68) MC4RMC1RMC3RMC5R
SCHEMBL21392271 0.87 MC4R (0.68) MC4RMC1RMC3RMC5R
SCHEMBL21392243 0.87 MC4R (0.68) MC4RMC1RMC3RMC5R
SCHEMBL21392362 0.86 MC4R (0.68) MC4RMC1RMC3RMC5R
SCHEMBL21392400 0.83 MC4R (0.53) MC4RMC1R
SCHEMBL21392293 0.83 MC4R (0.61) MC4RMC1RMC3RMC5R

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
Send feedback