SCHEMBL7357446

SCHEMBL7357446

O=[N+]([O-])c1cccc(-c2cc(Cc3ncc[nH]3)cc3ccoc23)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.48
PDE4B Q07343 1/20 0.48
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
MAPT P10636 4/20 0.39
MAPK1 P28482 1/20 0.39
PDE4D Q08499 2/20 0.39
GRM5 P41594 1/20 0.39
PLK1 P53350 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
F7 P08709 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
TOP1 P11387 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ADORA2A P29274 1/20 0.37

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
SCHEMBL7440230 0.83 PDE4A (0.71) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7933011 0.82 PDE4B (0.67) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7361224 0.82 PDE4A (0.53) PDE4APDE4BRAB9ANPC1MAPT
Hydrochloric Acid SCHEMBL7346847 0.81 PDE4B (0.66) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7349559 0.81 PDE4B (0.45) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7353267 0.81 PDE4A (0.53) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7355006 0.80 PDE4A (0.50) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7357039 0.80 PDE4B (0.51) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7352210 0.80 PDE4A (0.55) PDE4APDE4BRAB9ANPC1MAPT
SCHEMBL7354684 0.78 PDE4A (0.47) PDE4APDE4BRAB9ANPC1MAPT

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
EP-0834508-B1 Substituted biphenyl or phenylpyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-08-16 EP disclosed
US-5877190-A PHOSPHODIESTERASE INHIBITOR ADIR ET COMPAGNIE (FR) 1999-03-02 US disclosed
EP-0834508-A1 Substituted biphenyl or phenylpyridine derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-04-08 EP disclosed