SCHEMBL6879233

SCHEMBL6879233

CN(C)c1cc(N[C@H]2CC[C@@H](CNCc3c[nH]nc3-c3ccc(C(F)(F)F)cc3)CC2)nc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 8/20 0.46
ADRA2A P08913 6/20 0.46
NPY5R Q15761 4/20 0.46
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
VCP P55072 1/20 0.36
ACP1 P24666 3/20 0.35
SLC2A1 P11166 1/20 0.35
CRHR1 P34998 2/20 0.33
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 1/20 0.33
KDM1A O60341 1/20 0.33
TLR7 Q9NYK1 1/20 0.33

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
SCHEMBL6879236 1.00 MCHR1 (0.46) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876340 0.91 MCHR1 (0.46) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876335 0.91 MCHR1 (0.46) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL13796887 0.85 MCHR1 (0.61) MCHR1ADRA2ANPY5R
SCHEMBL6874396 0.84 MCHR1 (0.47) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6874392 0.84 MCHR1 (0.47) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6880079 0.82 MCHR1 (0.47) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6880085 0.82 MCHR1 (0.47) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876186 0.80 MCHR1 (0.45) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876180 0.80 MCHR1 (0.45) MCHR1ADRA2ANPY5RKDM4ELMNA

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