SCHEMBL7031287

SCHEMBL7031287

COc1ccc(C(N)=O)cc1OC1CCN(C)C1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDE4B Q07343 10/20 0.56
▸ PDE4D Q08499 5/20 0.56
▸ PDE4A P27815 3/20 0.56
▸ PDE4C Q08493 3/20 0.56
▸ MCHR1 Q99705 1/20 0.53
▸ CHEK2 O96017 1/20 0.52
▸ SLC5A7 Q9GZV3 3/20 0.50
▸ MAPK14 Q16539 1/20 0.50
▸ CYP2D6 P10635 1/20 0.49
▸ MAPK1 P28482 1/20 0.48

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
SCHEMBL5741829 0.87 OPRK1 (0.55) PDE4BPDE4DPDE4APDE4CMCHR1
SCHEMBL5742254 0.87 OPRK1 (0.55) PDE4BPDE4DPDE4APDE4CMCHR1
SCHEMBL6177433 0.87 OPRK1 (0.55) PDE4BPDE4DPDE4APDE4CMCHR1
SCHEMBL6176806 0.86 CHEK2 (0.51) CHEK2SLC5A7
SCHEMBL5743835 0.86 CHEK2 (0.51) CHEK2SLC5A7
SCHEMBL5741837 0.86 CHEK2 (0.51) PDE4BPDE4DPDE4APDE4CMCHR1
SCHEMBL5742176 0.83 UTS2R (0.51) CHEK2
SCHEMBL5744137 0.83 UTS2R (0.51) CHEK2
SCHEMBL4728938 0.82 PDE4B (0.80) PDE4BPDE4DPDE4APDE4CMAPK14
SCHEMBL7031279 0.81 PIK3CD (0.48) PDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 — — US claimed
CN-1246116-A Sulfonamide derivatives, process for their preparation and their use as medicaments SMITHKLINE BEECHAM PLC (GB) 2000-03-01 — — CN claimed
EP-0946539-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1999-10-06 — — EP claimed
WO-1998027081-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1998-06-25 — — WO claimed
US-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments SMITHKLINE BEECHAM P.L.C. 2003-04-10 — — US disclosed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 — — US disclosed
CN-1246116-A Sulfonamide derivatives, process for their preparation and their use as medicaments SMITHKLINE BEECHAM PLC (GB) 2000-03-01 — — CN disclosed
EP-0946539-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1999-10-06 — — EP disclosed
WO-1998027081-A1 SULPHONAMIDE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND THEIR USE AS MEDICAMENTS SMITHKLINE BEECHAM PLC (GB) 1998-06-25 — — 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-20030069233-A1 Sulphonamide derivatives, process for their preparation, and their use as medicaments TPMT, MPST, STS PDE4B 1287/4885PDE4D 1425/4885PDE4A 1688/4885

“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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