SCHEMBL6477253

SCHEMBL6477253

COc1ccc(C2=NN(C3CCNCC3)C(=O)[C@@H]3CC=CC[C@H]23)cc1OC

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 18/20 0.82
PDE4D Q08499 18/20 0.82
PDE4A P27815 17/20 0.82
PDE4C Q08493 17/20 0.82
PDE7A Q13946 2/20 0.68
PDE3B Q13370 1/20 0.68
PDE3A Q14432 1/20 0.68

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
Hydrochloric Acid SCHEMBL5569973 0.99 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CPDE7A
Hydrochloric Acid SCHEMBL5569972 0.99 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CPDE7A
Hydrochloric Acid SCHEMBL4016841 0.99 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL5558463 0.91 PDE4D (0.83) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL5558471 0.91 PDE4D (0.83) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL5558459 0.91 PDE4D (0.83) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL7142322 0.90 PDE4B (1.00) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL7142325 0.90 PDE4B (1.00) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL7142328 0.90 PDE4B (1.00) PDE4BPDE4DPDE4APDE4CPDE7A
SCHEMBL7140035 0.89 PDE4B (1.00) PDE4BPDE4DPDE4APDE4CPDE7A

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-6933296-B2 Compounds effective as β2-adrenoreceptor agonists as well as PDE4-inhibitors ALTANA PHARMA B.V. (NL) 2005-08-23 US disclosed
EP-1362044-A1 PHTHALAZINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA Pharma AG (DE) 2003-11-19 EP disclosed
US-20030195215-A1 Compounds effective as beta-2 adrenoreceptor agonists as well pde4-inhibitors ALTANA PHARMA B.V. (NL) 2003-10-16 US disclosed
EP-1296956-A1 COMPOUNDS EFFECTIVE AS BETA-2-ADRENORECEPTOR AGONISTS AS WELL AS PDE4-INHIBITORS ALTANA Pharma AG (DE) 2003-04-02 EP disclosed
WO-2002064584-A1 PHTHALAYINONE-PIPERIDINO-DERIVATIVES AS PDE4 INHIBITORS ALTANA PHARMA AG (DE) 2002-08-22 WO disclosed
WO-2001094319-A1 COMPOUNDS EFFECTIVE AS BETA-2-ADRENORECEPTOR AGONISTS AS WELL AS PDE4-INHIBITORS ALTANA PHARMA AG (DE) 2001-12-13 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 (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-20030195215-A1 Compounds effective as beta-2 adrenoreceptor agonists as well pde4-inhibitors ADRB1, ADRB2, ADRA1D PDE4B 11/4885PDE4D 19/4885PDE4A 10/4885

“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.