SCHEMBL3711289

SCHEMBL3711289

CCc1cc(OC2CCN(C(=O)OC(C)(C)C)CC2)c2ncccc2c1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 19/20 0.52
KCNH2 Q12809 19/20 0.52
PDE4A P27815 1/20 0.48
PDE4B Q07343 1/20 0.48
PDE4C Q08493 1/20 0.48
PDE4D Q08499 1/20 0.48

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
SCHEMBL1149079 0.91 HRH1 (0.64) HRH1KCNH2
SCHEMBL1147914 0.90 HRH1 (0.61) HRH1KCNH2
SCHEMBL3718500 0.90 HRH1 (0.52) HRH1KCNH2
SCHEMBL3715445 0.90 HRH1 (0.48) HRH1KCNH2PDE4APDE4BPDE4C
SCHEMBL3040390 0.89 HRH1 (0.60) HRH1KCNH2
SCHEMBL3709887 0.87 GPR119 (0.48) HRH1KCNH2PDE4APDE4BPDE4C
SCHEMBL3708948 0.87 GPR119 (0.51) HRH1KCNH2PDE4APDE4BPDE4C
SCHEMBL3055131 0.86 GPR119 (0.47) HRH1KCNH2PDE4APDE4BPDE4C
SCHEMBL1149124 0.86 CACNB4 (0.49) HRH1KCNH2PDE4APDE4BPDE4C
SCHEMBL1148995 0.86 HRH1 (0.60) HRH1KCNH2

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
WO-2010094643-A1 QUINOLINE DERIVATIVES AND THEIR USES FOR RHINITIS AND URTICARIA GLAXO GROUP LIMITED (GB) 2010-08-26 WO disclosed