SCHEMBL7362237

SCHEMBL7362237

COCC(C)Oc1cc(C(=O)O)ccc1OC(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 7/20 0.49
PDE4B Q07343 6/20 0.49
PDE4C Q08493 6/20 0.49
PDE4D Q08499 6/20 0.49
HTT P42858 2/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
TPMT P51580 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
KDM4E B2RXH2 1/20 0.45
TSHR P16473 1/20 0.43
GCK P35557 2/20 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
SCHEMBL7360308 0.87 CA12 (0.63) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL1029279 0.84 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7362652 0.83 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL21079189 0.83 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL3536547 0.81 CA12 (0.71) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL2564619 0.81 CA12 (0.71) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL15521539 0.81 PDE4D (0.51) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7362239 0.80 PDE4A (0.50) PDE4APDE4BPDE4CPDE4DHTT
SCHEMBL7351125 0.78 TAS1R3 (0.44) HTTLMNAMAPK1RAB9ACA12
SCHEMBL8072162 0.78 CA12 (0.51) PDE4APDE4BPDE4CPDE4DHTT

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-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