SCHEMBL6873131

SCHEMBL6873131

CN(C)c1cc(NC2CCC(CNCc3ccc(Cl)cc3)CC2)nc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.49
NPY5R Q15761 6/20 0.47
ADRA2A P08913 3/20 0.42
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CXCR4 P61073 2/20 0.39
VCP P55072 1/20 0.38
CAMK2D Q13557 2/20 0.38
APP P05067 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 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
SCHEMBL6873125 1.00 MCHR1 (0.49) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6874906 0.92 MCHR1 (0.49) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6874914 0.92 MCHR1 (0.49) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6867532 0.91 MCHR1 (0.50) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6877036 0.91 MCHR1 (0.50) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6867536 0.91 MCHR1 (0.50) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6877043 0.91 MCHR1 (0.50) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6875830 0.91 MCHR1 (0.48) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6875826 0.91 MCHR1 (0.48) MCHR1NPY5RADRA2AKDM4ELMNA
SCHEMBL6877690 0.89 MCHR1 (0.48) MCHR1NPY5RADRA2AKDM4ELMNA

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