SCHEMBL9634703

SCHEMBL9634703

O=C(O)COc1ccc(-c2nc3ncccc3[nH]2)c(O)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 6/20 0.57
PDE2A O00408 1/20 0.53
FAAH O00519 1/20 0.52
PRMT5 O14744 2/20 0.50
PDE4A P27815 2/20 0.50
PDE4B Q07343 2/20 0.50
PDE4C Q08493 2/20 0.50
PDE4D Q08499 2/20 0.50
ADORA2A P29274 1/20 0.49
ADORA2B P29275 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
SCHEMBL9636233 0.90 PDE2A (0.61) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9634845 0.88 PDE2A (0.56) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9635758 0.87 PDE2A (0.73) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9635750 0.86 PDE5A (0.61) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9635647 0.86 ADORA2A (0.55) PDE5APDE2AFAAHPRMT5PDE4A
SCHEMBL14090341 0.85 PRMT5 (0.70) PDE5APDE2APRMT5PDE4APDE4B
SCHEMBL9634549 0.83 PDE2A (0.53) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9635767 0.83 PDE2A (0.53) PDE5APDE2AFAAHPDE4APDE4B
SCHEMBL9635691 0.83 PRMT5 (0.67) FAAHPRMT5
SCHEMBL9635708 0.82 AURKA (0.66) FAAHPRMT5

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 3 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-A1 2-Arylimidazopyridines MERCK PATENT GmbH (DE) 1983-03-02 EP disclosed