SCHEMBL8891373

SCHEMBL8891373

COc1ccc(/C=C/c2cc(C(=O)Nc3c(Cl)cncc3Cl)ccc2OC)cc1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 10/20 0.65
PDE4A P27815 8/20 0.58
PDE4B Q07343 8/20 0.58
PDE4C Q08493 8/20 0.58
CYP2B6 P20813 1/20 0.54
SNCA P37840 2/20 0.47
GFER P55789 1/20 0.46
HDAC1 Q13547 2/20 0.46
HDAC8 Q9BY41 2/20 0.46
HDAC6 Q9UBN7 2/20 0.46
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL8891383 1.00 PDE4D (0.65) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7425558 0.81 PDE4D (0.72) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8890532 0.81 PDE4D (0.70) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL30614148 0.80 PDE4D (0.68) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL15270505 0.79 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL8890987 0.78 PDE4D (0.66) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL7421089 0.78 PDE4D (0.66) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL30614194 0.77 PDE4D (0.81) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL2908650 0.77 PDE4D (0.81) PDE4DPDE4APDE4BPDE4CCYP2B6
SCHEMBL6874729 0.77 PDE4D (0.81) PDE4DPDE4APDE4BPDE4CCYP2B6

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
WO-1997003967-A1 SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE RHONE-POULENC RORER LIMITED (GB) 1997-02-06 WO claimed
WO-1997003967-A1 SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE RHONE-POULENC RORER LIMITED (GB) 1997-02-06 WO disclosed