SCHEMBL6874137

SCHEMBL6874137

Cc1cccc([N+](=O)[O-])c1NC(=O)NCC1CCC(Nc2nc3c(c(N(C)C)n2)CCCC3)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.41
ADRA2A P08913 7/20 0.40
HTR2B P41595 4/20 0.40
ADRA1A P35348 3/20 0.40
HRH1 P35367 3/20 0.40
HTR1A P08908 1/20 0.38
NPY5R Q15761 2/20 0.38
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
ATG4B Q9Y4P1 2/20 0.35
KCNMA1 Q12791 1/20 0.35
KMT2A Q03164 2/20 0.33

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
SCHEMBL6874130 1.00 MCHR1 (0.41) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6464762 0.91 MCHR1 (0.46) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6458452 0.91 MCHR1 (0.46) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6464739 0.91 MCHR1 (0.40) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6464745 0.91 MCHR1 (0.40) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6878656 0.90 KMT2A (0.46) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6878661 0.90 KMT2A (0.46) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6876650 0.90 MCHR1 (0.44) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6876661 0.90 MCHR1 (0.44) MCHR1ADRA2AHTR2BADRA1AHRH1
SCHEMBL6459489 0.87 MCHR1 (0.43) MCHR1ADRA2AHTR2BADRA1AHRH1

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