SCHEMBL9635759

SCHEMBL9635759

C#CCOc1ccccc1-c1nc2ncccc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 18/20 0.70
PDE4A P27815 9/20 0.67
PDE4B Q07343 9/20 0.67
PDE4C Q08493 9/20 0.67
PDE4D Q08499 9/20 0.67
AURKA O14965 1/20 0.66
PDE2A O00408 1/20 0.51
METAP2 P50579 1/20 0.49
METAP1 P53582 1/20 0.49

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
SCHEMBL9636272 0.87 PDE5A (0.70) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635687 0.86 PDE5A (0.61) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634394 0.85 PDE2A (0.62) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635949 0.85 PDE5A (0.64) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634620 0.84 PDE5A (0.52) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634337 0.83 PDE5A (0.65) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL10734495 0.83 MAOB (0.49) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL2310980 0.83 ALDH1A1 (0.54) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634619 0.83 PDE2A (0.65) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9636334 0.83 PDE5A (0.67) PDE5APDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5104881-A 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-04-14 US disclosed
US-4616090-A 2-arylimidazopyridines intermediates MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1986-10-07 US disclosed
EP-0072926-B1 2-ARYLIMIDAZOPYRIDINES MERCK PATENT GmbH (DE) 1986-09-24 EP disclosed
EP-0072926-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed