SCHEMBL7688405

SCHEMBL7688405

CC(C)NC(=O)C(=Cc1cccc(-c2cc(C(C)(CI)S(C)(=O)=O)cc3cccnc23)c1)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.82

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 19/20 0.82
PDE4B Q07343 19/20 0.82
PDE4C Q08493 19/20 0.82
PDE4D Q08499 19/20 0.82
CYP2C9 P11712 2/20 0.55
KCNH2 Q12809 1/20 0.55

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
SCHEMBL4026424 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL4026428 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL6180681 0.87 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL6180684 0.87 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5144750 0.84 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL5144748 0.82 PDE4A (0.84) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL4028742 0.81 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL4028736 0.81 PDE4A (0.83) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL7453034 0.81 PDE4A (0.73) PDE4APDE4BPDE4CPDE4DCYP2C9
SCHEMBL4035326 0.80 PDE4A (0.81) PDE4APDE4BPDE4CPDE4DCYP2C9

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-20020103226-A1 Substituted 8-arylquinoline phosphodiesterase-4 inhibitors MERCK FROSST CANADA LTD. (CA) 2002-08-01 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-20020103226-A1 Substituted 8-arylquinoline phosphodiesterase-4 inhibitors 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.