SCHEMBL7944339

SCHEMBL7944339

CN=Cc1cc(Cc2ccc(F)cc2)cc(-c2cccc([N+](=O)[O-])c2)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PELI1 Q96FA3 2/20 0.39
GAA P10253 1/20 0.39
AKR1C3 P42330 2/20 0.38
AKR1C2 P52895 2/20 0.38
MAPT P10636 4/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
RECQL P46063 1/20 0.38
NOD2 Q9HC29 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
F7 P08709 4/20 0.38
CNR2 P34972 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAOA P21397 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
Hydrochloric Acid SCHEMBL7353084 0.99 PDE4A (0.41) PDE4APDE4BPELI1GAAAKR1C3
Hydrochloric Acid SCHEMBL7353088 0.99 PDE4A (0.41) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7357593 0.91 PDE4A (0.42) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7357600 0.91 PDE4A (0.42) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7354395 0.89 PDE4A (0.45) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7349221 0.81 F7 (0.46) PDE4APDE4BPELI1MAPTALDH1A1
SCHEMBL7349224 0.81 F7 (0.46) PDE4APDE4BPELI1MAPTALDH1A1
SCHEMBL7357532 0.80 ALDH1A1 (0.46) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7357536 0.80 ALDH1A1 (0.46) PDE4APDE4BPELI1GAAAKR1C3
SCHEMBL7358477 0.80 CNR2 (0.42) PDE4APDE4BPELI1GAAAKR1C3

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 2 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
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