SCHEMBL7047585

SCHEMBL7047585

CCCc1ccccc1NC(=O)NCC1CCC(Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.41
TP53 P04637 2/20 0.39
NPY5R Q15761 4/20 0.39
ADRA2A P08913 3/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 3/20 0.36
LMNA P02545 1/20 0.36
NAPEPLD Q6IQ20 2/20 0.36
ITGB3 P05106 2/20 0.35
ITGAV P06756 2/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.35
S1PR1 P21453 1/20 0.35
OPRD1 P41143 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL7047583 1.00 MCHR1 (0.41) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6875217 0.94 TP53 (0.45) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6875222 0.94 TP53 (0.45) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6874689 0.90 TP53 (0.45) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6874694 0.90 TP53 (0.45) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6867313 0.88 KDM4E (0.43) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6867311 0.88 KDM4E (0.43) MCHR1TP53NPY5RADRA2AMAPT
SCHEMBL6867914 0.87 ACP1 (0.44) MCHR1NPY5RADRA2AKDM4EKMT2A
SCHEMBL6867920 0.87 ACP1 (0.44) MCHR1NPY5RADRA2AKDM4EKMT2A
SCHEMBL6878430 0.87 NPY5R (0.43) MCHR1TP53NPY5RADRA2AMAPT

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