SCHEMBL5559142

SCHEMBL5559142

CCCCCCn1cc(C(=O)C(=O)Nc2c(Cl)cncc2Cl)c2cccnc21

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 4/20 0.67
▸ PDE4B Q07343 3/20 0.67
▸ PDE4C Q08493 3/20 0.67
▸ PDE4D Q08499 3/20 0.67
▸ CNR2 P34972 15/20 0.53
▸ CNR1 P21554 14/20 0.53
▸ KCNH2 Q12809 1/20 0.44

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
SCHEMBL5559134 0.90 CNR2 (0.59) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5558009 0.88 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5559131 0.86 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5553031 0.83 PDE4A (0.70) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL5469053 0.83 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL6224705 0.83 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DCNR2
SCHEMBL6220881 0.83 PDE4A (0.72) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL6223861 0.82 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL5559108 0.82 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DKCNH2
SCHEMBL5557937 0.82 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7169787-B2 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same ELBION AG (DE) 2007-01-30 — — US claimed
EP-1330455-B1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2005-08-03 — — EP claimed
US-20040106641-A1 Novel 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same BIOTIE THERAPIES GMBH (DE) 2004-06-03 — — US claimed
EP-1330455-B1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2005-08-03 — — EP 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-20040106641-A1 Novel 7-azaindoles, use thereof as phosphodiesterase 4 inhibitors and method for producing the same PDE4A, PDE4B, PDE4C PDE4A 1/4885PDE4B 2/4885PDE4C 3/4885

“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.

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