SCHEMBL5403218

SCHEMBL5403218

CN(C)CC(c1ccccc1Cl)N1CCN(C(=O)C(N)Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MC4R P32245 5/20 0.49
AKT1 P31749 13/20 0.48
AKT2 P31751 1/20 0.48
AKT1S1 Q96B36 1/20 0.48
AKT3 Q9Y243 1/20 0.48
DPP7 Q9UHL4 1/20 0.44

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
SCHEMBL14593547 0.90 MC4R (0.60) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL14593554 0.90 MC4R (0.60) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL5413808 0.90 MC4R (0.60) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL14593568 0.86 MC4R (0.50) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL5418110 0.83 MC4R (0.53) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL5411152 0.82 MC4R (0.54) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL5403199 0.81 MC4R (0.66) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL14593405 0.81 MC4R (0.66) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL14593420 0.80 MC4R (0.56) MC4RAKT1AKT2AKT1S1AKT3
SCHEMBL14593415 0.79 MC4R (0.57) MC4RAKT1AKT2AKT1S1AKT3

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