SCHEMBL9635685

SCHEMBL9635685

C#CCOc1ccc(-c2nc3ncccc3[nH]2)c(O)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 12/20 0.57
PDE2A O00408 1/20 0.53
PDE4A P27815 5/20 0.47
PDE4B Q07343 5/20 0.47
PDE4C Q08493 5/20 0.47
PDE4D Q08499 5/20 0.47
PRMT5 O14744 2/20 0.47
AURKA O14965 3/20 0.46
MGAM O43451 1/20 0.45
GAA P10253 1/20 0.45
SI P14410 1/20 0.45
MGAM2 Q2M2H8 1/20 0.45
PARP1 P09874 1/20 0.44

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
SCHEMBL9634777 0.88 PDE5A (0.57) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9634394 0.88 PDE2A (0.62) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9635780 0.85 PDE2A (0.75) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9634620 0.85 PDE5A (0.52) PDE5APDE2APDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL10906179 0.84 PDE2A (0.73) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9634842 0.84 PDE5A (0.63) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9634862 0.84 PDE2A (0.56) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL9635720 0.84 PDE2A (0.56) PDE5APDE2APDE4APDE4BPDE4C
SCHEMBL10742154 0.83 METAP2 (0.38) PDE5APDE2AMGAMGAASI
SCHEMBL9634782 0.83 PDE2A (0.53) PDE5APDE2APDE4APDE4BPDE4C

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