SCHEMBL6877115

SCHEMBL6877115

CC(C)c1ccccc1NC(=O)NC[C@H]1CC[C@@H](Nc2nc3c(c(N(C)C)n2)CCCC3)CC1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.40
ADRA2A P08913 6/20 0.40
ADRA1A P35348 3/20 0.40
HTR2B P41595 3/20 0.40
HRH1 P35367 2/20 0.40
HTR1A P08908 1/20 0.39
NPY5R Q15761 2/20 0.39
CXCR4 P61073 1/20 0.38
EPHX1 P07099 3/20 0.35
EPHX2 P34913 1/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL6877120 1.00 MCHR1 (0.40) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6462121 0.91 MCHR1 (0.42) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6462124 0.91 MCHR1 (0.42) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6878375 0.90 MCHR1 (0.44) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6878369 0.90 MCHR1 (0.44) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6873099 0.89 MCHR1 (0.41) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6873095 0.89 MCHR1 (0.41) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6457024 0.89 MCHR1 (0.42) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6457034 0.89 MCHR1 (0.42) MCHR1ADRA2AADRA1AHTR2BHRH1
SCHEMBL6878076 0.88 MCHR1 (0.41) MCHR1ADRA2AADRA1AHTR2BHRH1

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
EP-1464335-A2 Quinoline, tetrahydroquinoline and pyrimidine derivatives as mch antagonist Taisho Pharmaceutical Co. Ltd. (JP) 2004-10-06 EP disclosed