SCHEMBL5559243

SCHEMBL5559243

COc1ccc(NC(=O)C(=O)c2cn(Cc3ccc(F)cc3)c3ncccc23)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.63
▸ PDE4B Q07343 1/20 0.63
▸ PDE4C Q08493 1/20 0.63
▸ PDE4D Q08499 1/20 0.63
▸ MAPT P10636 7/20 0.51
▸ TP53 P04637 3/20 0.51
▸ THRB P10828 1/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ HCRTR1 O43613 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ MET P08581 1/20 0.44
▸ LMNA P02545 2/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 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
SCHEMBL5557916 0.83 PDE4A (0.68) PDE4APDE4BPDE4CPDE4DMAPT
Hydrochloric Acid SCHEMBL5557061 0.82 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL5557020 0.82 PDE4A (0.62) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL28521232 0.78 TUBB4A (0.56) POLBLMNAMEN1KMT2ATUBB4A
Elbimilast SCHEMBL1865431 0.77 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTP53
Elbimilast SCHEMBL29372217 0.77 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DTP53
SCHEMBL1860711 0.77 PDE4A (0.78) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL9278001 0.77 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL5559147 0.77 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DMAPT
SCHEMBL6222741 0.76 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DMAPT

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 6 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-A1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME Elbion AG (DE) 2003-07-30 — — EP claimed
WO-2002034747-A1 NOVEL 7-AZAINDOLES, USE THEREOF AS PHOSPHODIESTERASE 4 INHIBITORS AND METHOD FOR PRODUCING THE SAME ELBION AG (DE) 2002-05-02 — — WO 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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