SCHEMBL9634841

SCHEMBL9634841

C#CCOc1cc(OC)ccc1-c1nc2ncccc2[nH]1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.75
PDE5A O76074 15/20 0.57
AURKA O14965 3/20 0.57
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
CYP1A2 P05177 1/20 0.53
HPGD P15428 1/20 0.53
KMT2A Q03164 1/20 0.53
PDE3B Q13370 1/20 0.53
PDE3A Q14432 1/20 0.53
HSD17B10 Q99714 1/20 0.53
PDE4A P27815 8/20 0.52
PDE4B Q07343 8/20 0.52
PDE4C Q08493 8/20 0.52
PDE4D Q08499 8/20 0.52
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR3 P22607 1/20 0.46

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
SCHEMBL9634394 0.92 PDE2A (0.62) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9634619 0.91 PDE2A (0.65) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9635780 0.91 PDE2A (0.75) PDE2APDE5AAURKAKDM4EMEN1
Hydrochloric Acid SCHEMBL10906179 0.90 PDE2A (0.73) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9635743 0.90 PDE2A (0.60) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9634842 0.88 PDE5A (0.63) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9634862 0.87 PDE2A (0.56) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9635720 0.87 PDE2A (0.56) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL11772870 0.86 PDE2A (0.82) PDE2APDE5AAURKAKDM4EMEN1
SCHEMBL9634776 0.86 PDE2A (0.56) PDE2APDE5AAURKAKDM4EMEN1

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