SCHEMBL3871482

SCHEMBL3871482

COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2c3c(sc12)C(C(C)(C)C)N(C(=O)O)CC3

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 20/20 0.46
PDE4A P27815 19/20 0.45
PDE4B Q07343 19/20 0.45
PDE4C Q08493 19/20 0.45
PDE11A Q9HCR9 1/20 0.43

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
SCHEMBL73785 0.79 PDE4D (0.49) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL15016078 0.79 PDE4D (0.49) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL84494 0.77 PDE4D (0.51) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL73163 0.76 MKNK1 (0.46) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL8321734 0.75 PDE4D (0.55) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL84964 0.73 PDE4D (0.48) PDE4DPDE4APDE4BPDE4C
SCHEMBL8262616 0.73 PDE4D (0.52) PDE4DPDE4APDE4BPDE4CPDE11A
Hydrochloric Acid SCHEMBL72328 0.72 PDE4D (0.51) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL5023326 0.71 PDE4D (0.61) PDE4DPDE4APDE4BPDE4CPDE11A
SCHEMBL5619716 0.69 PDE4D (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1831227-B1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS GLENMARK PHARMACEUTICALS SA (CH) 2013-06-19 EP claimed
US-20090306082-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM GLENMARK PHARMACEUTICALS S.A. (CH) 2009-12-10 US claimed

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-20090306082-A1 NOVEL HETEROCYCLIC COMPOUNDS USEFUL FOR THE TREATMENT OF INFLAMMATORY AND ALLERGIC DISORDERS: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PTGER4, NOX4, PDE4A PDE4D 11/4885PDE4A 3/4885PDE4B 6/4885

“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.