SCHEMBL6878911

SCHEMBL6878911

CN(C)c1cc(NC2CCC(CNCc3ccccc3OC(F)(F)F)CC2)nc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.61
ADRA2A P08913 16/20 0.61
NPY5R Q15761 12/20 0.61
EPHX2 P34913 1/20 0.41
ACP1 P24666 1/20 0.41

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
SCHEMBL6878907 1.00 MCHR1 (0.61) MCHR1ADRA2ANPY5REPHX2ACP1
Hydrochloric Acid SCHEMBL6456269 0.99 MCHR1 (0.60) MCHR1ADRA2ANPY5REPHX2ACP1
SCHEMBL6463026 0.91 MCHR1 (0.75) MCHR1ADRA2ANPY5R
Hydrochloric Acid SCHEMBL6456014 0.90 MCHR1 (0.74) MCHR1ADRA2ANPY5R
SCHEMBL6876013 0.89 MCHR1 (0.52) MCHR1ADRA2ANPY5REPHX2ACP1
SCHEMBL6876020 0.89 MCHR1 (0.52) MCHR1ADRA2ANPY5REPHX2ACP1
SCHEMBL6875075 0.89 MCHR1 (0.50) MCHR1ADRA2ANPY5R
SCHEMBL6880013 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5R
SCHEMBL6456819 0.88 MCHR1 (0.49) MCHR1ADRA2ANPY5R
Hydrochloric Acid SCHEMBL6462112 0.86 ADRA2A (0.55) MCHR1ADRA2ANPY5REPHX2ACP1

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