SCHEMBL9635670

SCHEMBL9635670

O=C(O)COc1ccccc1-c1nc2ncccc2[nH]1

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 16/20 0.70
PDE4A P27815 9/20 0.70
PDE4B Q07343 9/20 0.70
PDE4C Q08493 9/20 0.70
PDE4D Q08499 9/20 0.70
AURKA O14965 1/20 0.64
MEN1 O00255 1/20 0.61
POLB P06746 1/20 0.61
KMT2A Q03164 1/20 0.61

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
SCHEMBL9636127 0.87 PDE5A (0.68) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9636233 0.86 PDE2A (0.61) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635028 0.85 PDE5A (0.72) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635758 0.81 PDE2A (0.73) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635750 0.80 PDE5A (0.61) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634782 0.80 PDE2A (0.53) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9634703 0.80 PDE5A (0.57) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL11771266 0.79 PDE5A (1.00) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9636272 0.79 PDE5A (0.70) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL9635759 0.79 PDE5A (0.70) 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 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