SCHEMBL7357162

SCHEMBL7357162

CCC(OC)Oc1cc(C(=O)Nc2c(F)cncc2F)ccc1OC(F)F

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.51
PDE4B Q07343 12/20 0.51
PDE4A P27815 4/20 0.51
PDE4C Q08493 4/20 0.51
ABCB11 O95342 1/20 0.51
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
POLB P06746 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7355273 0.89 PDE4D (0.65) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7354379 0.86 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7356069 0.84 PDE4D (0.42) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7357155 0.84 PDE4D (0.52) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7353627 0.79 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL7362239 0.77 PDE4A (0.50) PDE4DPDE4BPDE4APDE4CRAB9A
SCHEMBL2889923 0.76 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL30084849 0.76 PDE4D (0.74) PDE4DPDE4BPDE4APDE4CABCB11
SCHEMBL2887510 0.75 PDE4D (0.69) PDE4DPDE4BPDE4APDE4CNPC1
SCHEMBL2885258 0.75 CYP1A2 (0.58) PDE4DPDE4BPDE4APDE4CNPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP claimed
EP-0741707-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-11-13 EP claimed
WO-1995020578-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-08-03 WO claimed
EP-0741707-B1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE POULENC RORER LTD (GB) 1998-04-01 EP disclosed
EP-0741707-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-11-13 EP disclosed
WO-1995020578-A1 SUBSTITUTED AROMATIC COMPOUNDS AS c.AMP PHOSPHODIESTERASE- AND TNF-INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-08-03 WO disclosed