SCHEMBL4315191

SCHEMBL4315191

Nc1ncnc2c1nnn2CCCCOS(N)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE8B O95263 1/20 0.46
▸ CA1 P00915 9/20 0.39
▸ CA2 P00918 9/20 0.39
▸ CA9 Q16790 8/20 0.39
▸ CA4 P22748 3/20 0.39
▸ PDE3A Q14432 1/20 0.37
▸ CA12 O43570 2/20 0.37
▸ CA3 P07451 2/20 0.37
▸ CA6 P23280 2/20 0.37
▸ CA5A P35218 2/20 0.37
▸ CA7 P43166 2/20 0.37
▸ CA14 Q9ULX7 2/20 0.37
▸ CA5B Q9Y2D0 2/20 0.37
▸ ADORA2A P29274 2/20 0.36
▸ ADCY5 O95622 4/20 0.36
▸ TRPM2 O94759 1/20 0.35
▸ NSD2 O96028 1/20 0.34
▸ NSD3 Q9BZ95 1/20 0.34
▸ ATG7 O95352 1/20 0.34

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
SCHEMBL14201624 0.96 PDE8B (0.44) PDE8BCA1CA2CA9CA4
SCHEMBL7104678 0.77 ADORA2A (0.52) PDE8BADORA2A
SCHEMBL14201625 0.76 ADORA2A (0.57) PDE8BADORA2A
SCHEMBL21504439 0.70 PDE8B (0.52) PDE8BADORA2A
SCHEMBL21759036 0.69 PDE8B (0.46) PDE8BADORA2A
SCHEMBL13851102 0.69 ADORA2A (0.53) PDE8BADORA2A
SCHEMBL12379263 0.66 ENPP1 (0.60) CA1CA2CA9CA4ADORA2A
SCHEMBL763189 0.63 ADORA2A (0.53) ADORA2A
SCHEMBL8357822 0.62 ADORA2A (0.59) PDE8BADORA2A
SCHEMBL8357826 0.62 ADORA2A (0.59) PDE8BADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074126-A2 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2009-07-01 — — EP disclosed
US-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 — — US disclosed
WO-2008049105-A2 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF WYETH (US) 2008-04-24 — — 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-20080096903-A1 SULFAMOYL-CONTAINING DERIVATIVES AND USES THEREOF HSP90AB2P, HSP90AB1, HSP90AA1 PDE8B 3449/4885CA1 4466/4885CA2 4557/4885

“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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