SCHEMBL9634337

SCHEMBL9634337

C#CCOc1c(OC)cccc1-c1nc2ncccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.65
AURKA O14965 3/20 0.65
PDE4A P27815 9/20 0.54
PDE4B Q07343 9/20 0.54
PDE4C Q08493 9/20 0.54
PDE4D Q08499 9/20 0.54
PDE2A O00408 1/20 0.54
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49
HPGD P15428 1/20 0.49
KMT2A Q03164 1/20 0.49
PDE3B Q13370 1/20 0.49
PDE3A Q14432 1/20 0.49
HSD17B10 Q99714 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
SCHEMBL9635687 0.91 PDE5A (0.61) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9636334 0.90 PDE5A (0.67) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9635949 0.88 PDE5A (0.64) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9634875 0.84 PDE5A (0.57) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9635759 0.83 PDE5A (0.70) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9636135 0.83 AURKA (0.54) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9634270 0.81 PDE2A (0.61) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9635780 0.81 PDE2A (0.75) PDE5AAURKAPDE4APDE4BPDE4C
SCHEMBL9634658 0.81 PDE5A (0.52) PDE5AAURKAKDM4EMEN1ALDH1A1
Hydrochloric Acid SCHEMBL10906179 0.81 PDE2A (0.73) PDE5AAURKAPDE4APDE4BPDE4C

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