SCHEMBL5962264

SCHEMBL5962264

Cc1nc2ccncc2c(=O)n1-c1cccc(OCCCN2CCCC2)c1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.64
KCNH2 Q12809 17/20 0.64
ADRA1A P35348 1/20 0.63

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
SCHEMBL4469975 0.89 HRH3 (0.76) HRH3KCNH2ADRA1A
SCHEMBL4469847 0.89 HRH3 (0.77) HRH3KCNH2ADRA1A
SCHEMBL4471134 0.89 HRH3 (0.77) HRH3KCNH2ADRA1A
SCHEMBL4486556 0.87 HRH3 (0.81) HRH3KCNH2ADRA1A
SCHEMBL4465733 0.83 HRH3 (0.71) HRH3KCNH2ADRA1A
SCHEMBL4565297 0.82 HRH3 (0.57) HRH3KCNH2ADRA1A
SCHEMBL15555742 0.82 HRH3 (0.76) HRH3KCNH2ADRA1A
SCHEMBL4480853 0.82 HRH3 (0.62) HRH3KCNH2ADRA1A
SCHEMBL4462601 0.81 HRH3 (0.77) HRH3KCNH2ADRA1A
SCHEMBL4463008 0.81 HRH3 (0.77) HRH3KCNH2ADRA1A

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-1717230-B1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE MSD KK (JP) 2014-08-06 EP disclosed
EP-1717230-A1 FUSED-RING 4-OXOPYRIMIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-11-02 EP disclosed