SCHEMBL9634342

SCHEMBL9634342

C#CCOc1ccc(OC)cc1-c1nc2cnccc2[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
ACHE P22303 1/20 0.40
PDE2A O00408 1/20 0.39
PDE3B Q13370 1/20 0.39
PDE3A Q14432 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
RUNX1 Q01196 1/20 0.38
AURKA O14965 1/20 0.38
KDR P35968 1/20 0.38
GLA P06280 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TOP1 P11387 1/20 0.38
TOP2A P11388 1/20 0.38

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
SCHEMBL9634736 0.92 PDE2A (0.47) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL9636101 0.92 PDE5A (0.46) PDE5AKDM4EALDH1A1HPGDPDE2A
SCHEMBL9636217 0.88 MAOB (0.41) PDE5AKDM4EALDH1A1HPGDNPC1
SCHEMBL7281035 0.85 PDE5A (0.55) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL9634540 0.85 PDE5A (0.47) PDE5AKDM4EALDH1A1HPGDPDE2A
SCHEMBL10962083 0.85 PDE5A (0.42) PDE5AKDM4EALDH1A1HPGDPDE2A
Hydrochloric Acid SCHEMBL10844959 0.84 PDE5A (0.56) PDE5AKDM4EALDH1A1HPGDACHE
Hydrochloric Acid SCHEMBL7272791 0.84 PDE5A (0.56) PDE5AKDM4EALDH1A1HPGDACHE
SCHEMBL9634591 0.84 TOP1 (0.40) PDE5AACHEPDE2APDE3BPDE3A
SCHEMBL9634624 0.82 CBFB (0.41) PDE5AKDM4EALDH1A1HPGDPDE2A

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