SCHEMBL6950195

SCHEMBL6950195

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2[nH]c(C(F)(F)F)nc12

nearest known ligand 0.85

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.85
PDE4A P27815 19/20 0.85
PDE4B Q07343 19/20 0.85
PDE4C Q08493 19/20 0.85
PDE11A Q9HCR9 2/20 0.64
PDE3B Q13370 1/20 0.53

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
SCHEMBL6950193 0.92 PDE4D (1.00) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552658 0.85 PDE4D (0.70) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552602 0.85 PDE4D (0.84) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552877 0.82 PDE4D (0.85) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552882 0.82 PDE4D (0.85) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553759 0.81 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553041 0.81 PDE4D (0.85) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1552878 0.79 PDE4D (0.86) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553232 0.79 PDE4D (0.59) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL1553933 0.79 PDE4D (0.86) PDE4DPDE4APDE4BPDE4CPDE11A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0944616-B1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-06-04 EP claimed
US-20020094987-A1 Bicyclic aryl carboxamides and their therapeutic use DYKE HAZEL JOAN (GB) 2002-07-18 US claimed
EP-0944616-A1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE Darwin Discovery Limited (GB) 1999-09-29 EP claimed
WO-1998022460-A1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LIMITED (GB) 1998-05-28 WO claimed
EP-0944616-B1 BICYCLIC ARYL CARBOXAMIDES AND THEIR THERAPEUTIC USE DARWIN DISCOVERY LTD (GB) 2003-06-04 EP disclosed
US-20020094987-A1 Bicyclic aryl carboxamides and their therapeutic use DYKE HAZEL JOAN (GB) 2002-07-18 US disclosed
US-6353010-B1 ENZYME INHIBITORS TUMOR NECROSIS FACTOR AND PHOSPHODIESTERASE FOR ANTIINFLAMMATORY AGENTS DARWIN DISCOVERY, LTD. (GB) 2002-03-05 US 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 (1 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-20020094987-A1 Bicyclic aryl carboxamides and their therapeutic use PDE3B, PDE3A, PDE2A PDE4D 25/4885PDE4A 9/4885PDE4B 12/4885

“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.