SCHEMBL336280

SCHEMBL336280

O=c1ccc2ncc(=O)n3c2n1C[C@H]3COS(=O)(=O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.39
CYP1A2 P05177 3/20 0.33
USP2 O75604 2/20 0.33
CYP2C19 P33261 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
GLA P06280 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
PARL Q9H300 1/20 0.33
MAPK1 P28482 1/20 0.32
METAP2 P50579 1/20 0.31
METAP1 P53582 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL10128106 0.81 TOP2A (0.42) TOP2ACYP1A2USP2CYP2C19ALDH1A1
SCHEMBL21935843 0.78 TOP2A (0.44) TOP2ACYP1A2USP2CYP2C19ALDH1A1
SCHEMBL3360410 0.76 TOP2A (0.38) TOP2A
SCHEMBL21935842 0.74 TOP2A (0.42) TOP2ACYP1A2USP2CYP2C19ALDH1A1
SCHEMBL1433450 0.72 TOP2A (0.36) TOP2ACYP1A2ALDH1A1
SCHEMBL21898783 0.71 TOP2A (0.39) TOP2ACYP1A2USP2CYP2C19ALDH1A1
SCHEMBL19706805 0.69 TOP2A (0.39) TOP2ACYP1A2USP2CYP2C19ALDH1A1
Hydrochloric Acid SCHEMBL3328806 0.69 TOP2A (0.41) TOP2ACYP1A2ALDH1A1CLK4CYP2C9
SCHEMBL21372391 0.68 TOP2A (0.33) TOP2A
SCHEMBL21372395 0.67 TOP2A (0.32) TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300476-B1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS GLAXO GROUP LTD (GB) 2014-01-08 EP disclosed
US-8097628-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-01-17 US disclosed
EP-2300476-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS Glaxo Group Limited (GB) 2011-03-30 EP disclosed
US-20090306089-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2009-12-10 US disclosed
WO-2009141398-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS AND THEIR USE AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2009-11-26 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-20090306089-A1 COMPOUNDS SDHA, NQO1, SDHB TOP2A 838/4885CYP1A2 80/4885USP2 4329/4885

“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.