SCHEMBL7357686

SCHEMBL7357686

COc1ncc(C(=O)Nc2cc(Cl)nc(Cl)c2)cc1OC1CCOC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.42
PDE4D Q08499 8/20 0.42
PDE4A P27815 4/20 0.42
PDE4B Q07343 4/20 0.42
PDE4C Q08493 4/20 0.42
POLQ O75417 2/20 0.41
GRM4 Q14833 1/20 0.41
LRRK2 Q5S007 1/20 0.41
EGFR P00533 2/20 0.41
ITK Q08881 1/20 0.41
CHEK1 O14757 1/20 0.40
HPGDS O60760 1/20 0.40
ABL1 P00519 1/20 0.40
PDE10A Q9Y233 1/20 0.40

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
SCHEMBL8554705 0.89 GRM4 (0.43) GRM5PDE4DPDE4APDE4BPDE4C
SCHEMBL7359762 0.85 PDE4D (0.56) PDE4DPDE4APDE4BPDE4CPOLQ
SCHEMBL7356931 0.82 PDE4D (0.44) GRM5PDE4DPDE4APDE4BPDE4C
SCHEMBL7358483 0.81 PDE4D (0.49) PDE4DPDE4APDE4BPDE4CLRRK2
SCHEMBL7362112 0.80 PDE4D (0.50) PDE4DPDE4APDE4BPDE4C
SCHEMBL7352793 0.79 BRD4 (0.42) GRM5PDE4DPDE4APDE4BPDE4C
SCHEMBL7363509 0.75 PDE4D (0.49) PDE4DPDE4APDE4BPDE4CLRRK2
SCHEMBL7363473 0.72 PDE4D (0.66) PDE4DPDE4APDE4BPDE4C
SCHEMBL7357750 0.71 LMNA (0.68) PDE4DPDE4APDE4BPDE4C
SCHEMBL70380 0.71 PDE4D (0.72) PDE4DPDE4APDE4BPDE4C

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