SCHEMBL5405542

SCHEMBL5405542

CS(=O)(=O)NCC(C1CCCCC1)N1CCN(C(=O)C(Cc2ccc(Cl)cc2)NC(=O)CC2NCc3ccccc32)CC1

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MC4R P32245 20/20 0.74
MC5R P33032 1/20 0.59
MC3R P41968 1/20 0.59
MC1R Q01726 1/20 0.59

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
SCHEMBL14592982 1.00 MC4R (0.74) MC4RMC5RMC3RMC1R
Trifluoroacetic Acid SCHEMBL5411134 0.96 MC4R (0.69) MC4RMC5RMC3RMC1R
SCHEMBL5400500 0.93 MC4R (0.72) MC4RMC5RMC3RMC1R
SCHEMBL14593077 0.93 MC4R (0.72) MC4RMC5RMC3RMC1R
Trifluoroacetic Acid SCHEMBL5405980 0.90 MC4R (0.67) MC4RMC5RMC3RMC1R
SCHEMBL14593142 0.89 MC4R (0.77) MC4RMC5RMC3RMC1R
SCHEMBL14593258 0.89 MC4R (0.72) MC4RMC5RMC3RMC1R
Hydrochloric Acid SCHEMBL5409303 0.88 MC4R (0.72) MC4RMC5RMC3RMC1R
SCHEMBL14593028 0.88 MC4R (0.75) MC4RMC5RMC3RMC1R
SCHEMBL5406128 0.88 MC4R (0.75) MC4RMC5RMC3RMC1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US claimed
US-20040116699-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 2004-06-17 US claimed
EP-1358163-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-11-05 EP claimed
WO-2002059095-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO claimed
US-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed
US-20040116699-A1 Melanocortin receptor agonists ELI LILLY AND COMPANY 2004-06-17 US disclosed
EP-1358163-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2003-11-05 EP disclosed
WO-2002059095-A1 MELANOCORTIN RECEPTOR AGONISTS ELI LILLY AND COMPANY (US) 2002-08-01 WO disclosed