SCHEMBL5758401

SCHEMBL5758401

CS(=O)(=O)c1ccc(CN)cn1.CS(=O)(=O)c1ccc(CN)cn1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.42
PIP5K1C O60331 1/20 0.42
PIK3CB P42338 1/20 0.42
PI4KA P42356 1/20 0.42
PIK3CG P48736 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
PSIP1 O75475 1/20 0.41
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA12 O43570 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA5A P35218 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
CA14 Q9ULX7 2/20 0.39
CA5B Q9Y2D0 1/20 0.39
HTR2A P28223 1/20 0.39
KCNH2 Q12809 1/20 0.39
RORC P51449 1/20 0.39

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
SCHEMBL1145511 1.00 PIK3CD (0.42) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL27624347 0.87 USP28 (0.38) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL3129807 0.83 PSIP1 (0.53) PSIP1CA1CA2CA12CA4
SCHEMBL13180189 0.82 KDM4E (0.41) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL12409435 0.82 CA2 (0.57) PSIP1CA1CA2CA12CA4
Hydrochloric Acid SCHEMBL1871819 0.81 CYP2A6 (0.41) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
Hydrochloric Acid SCHEMBL23144996 0.81 CA2 (0.55) PSIP1CA1CA2CA12CA4
SCHEMBL2643755 0.81 PIK3CD (0.39) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL485448 0.81 PIK3CD (0.39) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG
SCHEMBL20489229 0.81 PIK3CD (0.39) PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562902-B1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2006-05-03 EP disclosed
US-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase ASRAZENECA AB (SE) 2006-02-16 US disclosed
EP-1562902-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE AstraZeneca AB (SE) 2005-08-17 EP disclosed
WO-2004043924-A1 2-PYRIDONE DERIVATIVES AS INHIBITORS OF NEUTROPHILE ELASTASE ASTRAZENECA AB (SE) 2004-05-27 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-20060035938-A1 2-Pyridone derivatives as inhibitors of neutrophile elastase SERPINB1, ELANE, SERPINE1 PIK3CD 3904/4885PIP5K1C 2488/4885PIK3CB 3474/4885

“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.