SCHEMBL6879308

SCHEMBL6879308

Cc1cc(N(C)C)nc(NC2CCC(NC(=O)c3cccnc3S(=O)(=O)c3ccc(Cl)cc3)CC2)n1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 18/20 0.65
▸ ADRA2A P08913 7/20 0.65
▸ HRH1 P35367 4/20 0.65
▸ HTR2B P41595 3/20 0.65
▸ ADRA1A P35348 2/20 0.65
▸ CNR1 P21554 1/20 0.50
▸ KCNH2 Q12809 1/20 0.50
▸ AURKB Q96GD4 1/20 0.50
▸ PDE4B Q07343 1/20 0.38

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
SCHEMBL6879304 1.00 MCHR1 (0.65) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6874709 0.93 MCHR1 (0.58) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6874713 0.93 MCHR1 (0.58) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6462040 0.92 MCHR1 (0.65) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6462045 0.92 MCHR1 (0.65) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6868296 0.92 MCHR1 (0.54) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6868303 0.92 MCHR1 (0.54) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6877872 0.92 MCHR1 (0.65) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6877864 0.92 MCHR1 (0.65) MCHR1ADRA2AHRH1HTR2BADRA1A
SCHEMBL6877375 0.90 MCHR1 (0.61) MCHR1ADRA2AHRH1HTR2BADRA1A

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
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