SCHEMBL4940552

SCHEMBL4940552

COc1ccc(C2=NN(c3ccc(Br)cc3)C(=O)C(C)(C)C2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 12/20 0.51
PDE4A P27815 5/20 0.51
PDE4C Q08493 5/20 0.51
PDE4D Q08499 5/20 0.51
PDCD1 Q15116 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
ADAM17 P78536 1/20 0.42
GAA P10253 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ACHE P22303 1/20 0.42
MAOB P27338 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL4945670 0.89 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDCD1
SCHEMBL4944690 0.87 PDE5A (0.53) PDE4BPDE4APDE4CPDE4DCA1
SCHEMBL4942500 0.85 MAPT (0.48) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL4937419 0.83 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDCD1
SCHEMBL4937823 0.81 PDE4B (0.47) PDE4BPDE4APDE4CPDE4DPDCD1
SCHEMBL4944537 0.81 PDE4B (0.51) PDE4BPDE4APDE4CPDE4DPDCD1
SCHEMBL4943052 0.81 PDE4B (0.53) PDE4BPDE4APDE4CPDE4DPDCD1
SCHEMBL4937607 0.80 MAPT (0.54) PDE4BPDE4APDE4CPDE4D
SCHEMBL20138653 0.79 GAA (0.48) PDE4BPDE4APDE4CPDE4DGAA
SCHEMBL4943065 0.77 HTT (0.57) PDE4BPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080227790-A1 Pyridazinone Derivatives and their Use as Pde4 Inhibitors ALTANA PHARMA AG (DE) 2008-09-18 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-20080227790-A1 Pyridazinone Derivatives and their Use as Pde4 Inhibitors PDE4A, PDE4B, PDE5A PDE4B 2/4885PDE4A 1/4885PDE4C 7/4885

“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.