SCHEMBL5406030

SCHEMBL5406030

CCN(CC)CC(c1ccc(Cl)cc1)N1CCN(C(=O)C(N)Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 15/20 0.48
MC4R P32245 3/20 0.48
MC5R P33032 1/20 0.47
MC3R P41968 1/20 0.47
MC1R Q01726 1/20 0.47
AKT2 P31751 1/20 0.46
AKT1S1 Q96B36 1/20 0.46
AKT3 Q9Y243 1/20 0.46
DPP7 Q9UHL4 1/20 0.45

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
SCHEMBL14593526 1.00 AKT1 (0.48) AKT1MC4RMC5RMC3RMC1R
SCHEMBL14593549 0.96 AKT1 (0.49) AKT1MC4RMC5RMC3RMC1R
SCHEMBL5400393 0.95 MC4R (0.52) AKT1MC4RMC5RMC3RMC1R
SCHEMBL14593543 0.95 MC4R (0.52) AKT1MC4RMC5RMC3RMC1R
SCHEMBL5409228 0.93 MC4R (0.57) AKT1MC4RMC5RMC3RMC1R
SCHEMBL5411289 0.91 MC4R (0.48) AKT1MC4RMC5RMC3RMC1R
SCHEMBL14593511 0.89 AKT1 (0.48) AKT1MC4RMC5RMC3RMC1R
SCHEMBL14593547 0.87 MC4R (0.60) AKT1MC4RMC5RMC3RMC1R
SCHEMBL14593554 0.87 MC4R (0.60) AKT1MC4RMC5RMC3RMC1R
SCHEMBL5413808 0.87 MC4R (0.60) AKT1MC4RMC5RMC3RMC1R

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-7169777-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-01-30 US disclosed