SCHEMBL6877003

SCHEMBL6877003

CCOc1c(Br)cc(Br)cc1CNC[C@H]1CC[C@@H](Nc2cc(N(C)C)c3ccccc3n2)CC1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 10/20 0.47
ADRA2A P08913 9/20 0.47
NPY5R Q15761 5/20 0.47
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL6877008 1.00 MCHR1 (0.47) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6466000 0.92 MCHR1 (0.48) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6872379 0.92 MCHR1 (0.48) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6874805 0.88 MCHR1 (0.53) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6874809 0.88 MCHR1 (0.53) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL13797281 0.85 MCHR1 (0.65) MCHR1ADRA2ANPY5R
SCHEMBL6880013 0.85 MCHR1 (0.49) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6456819 0.85 MCHR1 (0.49) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876855 0.84 MCHR1 (0.46) MCHR1ADRA2ANPY5RKDM4ELMNA
SCHEMBL6876857 0.84 MCHR1 (0.46) 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