SCHEMBL69331

SCHEMBL69331

COc1cc(F)c(C(=O)Nc2c(Cl)cncc2Cl)cc1OC1CCCC1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 15/20 0.68
PDE4B Q07343 13/20 0.68
PDE4A P27815 11/20 0.68
PDE4C Q08493 11/20 0.68
SCN9A Q15858 2/20 0.52
GFER P55789 1/20 0.48
SCN5A Q14524 1/20 0.48

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
SCHEMBL70892 0.93 PDE4D (0.60) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL71400 0.90 PDE4D (0.56) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL71980 0.90 PDE4B (0.54) PDE4DPDE4BPDE4APDE4CGFER
SCHEMBL71344 0.89 PDE4D (0.55) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL72303 0.89 PDE4D (0.56) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL71459 0.88 PDE4D (0.54) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL70579 0.88 PDE4D (0.69) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL71215 0.88 PDE4D (0.53) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL73052 0.88 PDE4D (0.54) PDE4DPDE4BPDE4APDE4CSCN9A
SCHEMBL71725 0.88 PDE4B (0.57) PDE4DPDE4BPDE4APDE4CSCN9A

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240677-A1 Compounds as PDE IV and TNF Inhibitors AVENTIS PHARMA LIMITED (GB) 2010-09-23 US claimed
US-7045660-B2 Compounds as PDE IV and TNF-inhibitors AVENTIS PHARMA LIMITED (GB) 2006-05-16 US claimed
US-20040171618-A1 Compounds as PDE IV and TNF-inhibitors AVENTIS PHARMA LIMITED (GB) 2004-09-02 US claimed
US-20030013713-A1 Compounds as PDE IV and TNF-inhibitors FENTON GARRY (GB) 2003-01-16 US claimed
EP-0711282-A1 COMPOUNDS AS PDE IV AND TNF INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-05-15 EP claimed
WO-1995004045-A1 COMPOUNDS AS PDE IV AND TNF INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-02-09 WO claimed
US-8399466-B2 Composition for regenerative treatment of cartilage disease MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-03-19 US disclosed
US-8399466-B2 Composition for regenerative treatment of cartilage disease MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-03-19 US disclosed
US-8252794-B2 Composition for regenerative treatment of cartilage disease MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-28 US disclosed
US-8252794-B2 Composition for regenerative treatment of cartilage disease MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-28 US disclosed
US-8129537-B2 Compounds as PDE IV and TNF inhibitors RHONE-POULENC RORER LIMITED (GB) 2012-03-06 US disclosed
US-20100240677-A1 Compounds as PDE IV and TNF Inhibitors AVENTIS PHARMA LIMITED (GB) 2010-09-23 US disclosed
US-20100226993-A1 COMPOSITION FOR REGENERATIVE TREATMENT OF CARTILAGE DISEASE TANABE SEIYAKU CO., LTD. 2010-09-09 US disclosed
US-20030013713-A1 Compounds as PDE IV and TNF-inhibitors FENTON GARRY (GB) 2003-01-16 US disclosed
US-6472412-B1 Compounds as PDE IV and TNF inhibitors AVENTIS PHARMA LIMITED (GB) 2002-10-29 US disclosed
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
EP-0711282-A1 COMPOUNDS AS PDE IV AND TNF INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1996-05-15 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
WO-1995004045-A1 COMPOUNDS AS PDE IV AND TNF INHIBITORS RHONE-POULENC RORER LIMITED (GB) 1995-02-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100226993-A1 COMPOSITION FOR REGENERATIVE TREATMENT OF CARTILAGE DISEASE PDE4B, PDE4A, PDE4C PDE4D 6/4885PDE4B 1/4885PDE4A 2/4885
US-20030013713-A1 Compounds as PDE IV and TNF-inhibitors PDE4A, PDE4B, PDE7A PDE4D 7/4885PDE4B 2/4885PDE4A 1/4885
US-20100240677-A1 Compounds as PDE IV and TNF Inhibitors PDE4A, PDE4B, PDE7A PDE4D 7/4885PDE4B 2/4885PDE4A 1/4885
US-20040171618-A1 Compounds as PDE IV and TNF-inhibitors PDE4A, PDE4B, PDE7A PDE4D 7/4885PDE4B 2/4885PDE4A 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.