SCHEMBL3958428

SCHEMBL3958428

CC(C)COC(=O)N1CCN(CCN)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 3/20 0.47
HRH1 P35367 3/20 0.47
ALOX15 P16050 1/20 0.42
KIT P10721 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
RAB9A P51151 1/20 0.40
PIK3CD O00329 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL3632495 0.87 HRH2 (0.47) HRH2HRH1KITHRH3RAB9A
SCHEMBL1692682 0.85 HRH2 (0.48) HRH2HRH1KITHRH3RAB9A
SCHEMBL14922331 0.85 HRH2 (0.54) HRH2HRH1KITHRH3RAB9A
SCHEMBL18482713 0.84 HRH2 (0.47) HRH2HRH1KITHRH3RAB9A
SCHEMBL4050766 0.83 ALDH1A1 (0.53) HRH2HRH1ALOX15ALDH1A1KDM4E
SCHEMBL24664442 0.83 HRH2 (0.49) HRH2HRH1KITHRH3RAB9A
SCHEMBL10089203 0.81 HRH2 (0.47) HRH2HRH1KITHRH3RAB9A
SCHEMBL18482715 0.81 HRH2 (0.46) HRH2HRH1KITHRH3RAB9A
SCHEMBL8921640 0.81 RAB9A (0.45) HRH2HRH1KITHRH3RAB9A
SCHEMBL1726189 0.80 HRH2 (0.45) HRH2HRH1KITHRH3RAB9A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079738-A2 7-AZAINDOLE DERIVATIVES AS C-MET KINASE INHIBITORS Glaxo Group Limited (GB) 2009-07-22 EP disclosed
WO-2008049855-A2 7-AZAINDOLE DERIVATIVES AS C-MET KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2008-05-02 WO disclosed