SCHEMBL6877323

SCHEMBL6877323

COc1ccc2ccccc2c1CNCC1CCC(Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.44
ADRA2A P08913 2/20 0.43
NPY5R Q15761 2/20 0.43
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
KMT2A Q03164 5/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
APP P05067 2/20 0.41
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 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
SCHEMBL6877318 1.00 MCHR1 (0.44) MCHR1ADRA2ANPY5RKDM1AMAOA
SCHEMBL6868214 0.92 MCHR1 (0.46) MCHR1ADRA2ANPY5RKMT2AMEN1
SCHEMBL6455511 0.92 MCHR1 (0.46) MCHR1ADRA2ANPY5RKMT2AMEN1
SCHEMBL6877157 0.89 MCHR1 (0.51) MCHR1ADRA2AKDM1AMAOAKMT2A
SCHEMBL6877152 0.89 MCHR1 (0.51) MCHR1ADRA2AKDM1AMAOAKMT2A
SCHEMBL6877347 0.89 MCHR1 (0.45) MCHR1ADRA2ANPY5RKMT2APOLB
SCHEMBL6877351 0.89 MCHR1 (0.45) MCHR1ADRA2ANPY5RKMT2APOLB
SCHEMBL6874814 0.87 MCHR1 (0.49) MCHR1ADRA2ANPY5RKDM1AMAOA
SCHEMBL6873706 0.87 ACHE (0.54) MCHR1ADRA2ANPY5RKMT2AMEN1
SCHEMBL6462424 0.87 MCHR1 (0.49) MCHR1ADRA2ANPY5RKDM1AMAOA

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