SCHEMBL9634904

SCHEMBL9634904

C=CCOc1cc(OCCO)ccc1-c1nc2cnccc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 7/20 0.39
CHEK2 O96017 2/20 0.37
GCGR P47871 2/20 0.37
MAPK13 O15264 1/20 0.37
MAPK12 P53778 1/20 0.37
MAPK11 Q15759 1/20 0.37
MAPK14 Q16539 1/20 0.37
PDE3B Q13370 3/20 0.37
PDE3A Q14432 3/20 0.37
P2RY12 Q9H244 2/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
PDE2A O00408 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9634469 0.96 PDE5A (0.41) PDE5ACHEK2GCGRMAPK13MAPK12
SCHEMBL9635742 0.92 PDE5A (0.39) PDE5AGCGRMAPK13MAPK12MAPK11
SCHEMBL9636138 0.91 PDE5A (0.46) PDE5ACHEK2GCGRMAPK13MAPK12
SCHEMBL9634764 0.88 CBFB (0.41) PDE5AGCGRMAPK13MAPK12MAPK11
SCHEMBL9634828 0.87 PDE5A (0.45) PDE5ACHEK2GCGRMAPK13MAPK12
SCHEMBL7277622 0.87 PDE2A (0.47) PDE5APDE3BPDE3ALMNASMN1; SMN2
SCHEMBL9636296 0.86 PDE3B (0.39) PDE5APDE3BPDE3AP2RY12LMNA
SCHEMBL9635794 0.86 PDE5A (0.40) PDE5AGCGRMAPK13MAPK12MAPK11
Hydrochloric Acid SCHEMBL10848480 0.86 PDE2A (0.46) PDE5APDE3BPDE3ALMNASMN1; SMN2
SCHEMBL9634601 0.85 TOP1 (0.36) PDE5AGCGRMAPK13MAPK12MAPK11

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