SCHEMBL6869089

SCHEMBL6869089

CCOc1ccccc1CNC1CCC(Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.51
ADRA2A P08913 2/20 0.46
LMNA P02545 2/20 0.41
KDM4E B2RXH2 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM1A O60341 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2D6 P10635 2/20 0.38
TSHR P16473 2/20 0.38
ALOX15 P16050 1/20 0.38
TP53 P04637 1/20 0.38
TACR1 P25103 1/20 0.38
NPY5R Q15761 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
USP2 O75604 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6869085 1.00 MCHR1 (0.51) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6880013 0.89 MCHR1 (0.49) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6456819 0.89 MCHR1 (0.49) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6866944 0.85 MCHR1 (0.55) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6866938 0.85 MCHR1 (0.55) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6876436 0.84 MCHR1 (0.52) MCHR1SMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL6876428 0.84 MCHR1 (0.52) MCHR1SMN1; SMN2CYP1A2CYP3A4MEN1
SCHEMBL6875666 0.83 MCHR1 (0.54) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6875671 0.83 MCHR1 (0.54) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2
SCHEMBL6874473 0.83 MCHR1 (0.50) MCHR1ADRA2ALMNAKDM4ESMN1; SMN2

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