SCHEMBL7349929

SCHEMBL7349929

CO/C=C/c1cc(Cc2ccccc2)cc(-c2cccc([N+](=O)[O-])c2)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PELI1 Q96FA3 3/20 0.43
PDE4B Q07343 2/20 0.42
PDE4A P27815 1/20 0.42
F7 P08709 4/20 0.42
PTPN1 P18031 1/20 0.40
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
MAOA P21397 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39

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
SCHEMBL7349935 1.00 PELI1 (0.43) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7347491 0.87 PDE4A (0.43) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7347487 0.87 PDE4A (0.43) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7359628 0.86 PDE4A (0.47) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7352832 0.86 PDE4A (0.42) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7352837 0.86 PDE4A (0.42) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7357536 0.85 ALDH1A1 (0.46) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7357532 0.85 ALDH1A1 (0.46) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7349224 0.82 F7 (0.46) PELI1PDE4BPDE4AF7PTPN1
SCHEMBL7349221 0.82 F7 (0.46) PELI1PDE4BPDE4AF7PTPN1

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