SCHEMBL3664837

SCHEMBL3664837

Cc1cc(OS(=O)(=O)C(F)(F)F)cc(=O)n1Cc1cccnc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NOX4 Q9NPH5 4/20 0.44
CYBB P04839 1/20 0.44
BRD4 O60885 1/20 0.41
GABRA1 P14867 5/20 0.40
GABRA5 P31644 5/20 0.40
ALDH1A1 P00352 2/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TP53 P04637 1/20 0.40
CASP1 P29466 1/20 0.40
CASP7 P55210 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRIN1 Q05586 6/20 0.39
GRIN2B Q13224 6/20 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
SCHEMBL4379935 0.81 MAPK14 (0.43) NOX4CYBBBRD4GABRA1GABRA5
SCHEMBL22264250 0.79 ADAMTS4 (0.39) ALDH1A1
SCHEMBL29988521 0.79 ADAMTS4 (0.39) ALDH1A1
SCHEMBL1861393 0.79 NOX4 (0.43) NOX4CYBBBRD4GABRA1GABRA5
SCHEMBL3657215 0.76 TLR7 (0.44) BRD4
SCHEMBL4376936 0.74 LMNA (0.52) NOX4CYBBBRD4GABRA1GABRA5
SCHEMBL4481745 0.74 ALDH1A1 (0.47) BRD4ALDH1A1LMNA
SCHEMBL4382982 0.74 MAPK14 (0.51) GRIN1GRIN2B
SCHEMBL31381681 0.74 PTGS1 (0.34)
SCHEMBL3665175 0.71 ALDH1A1 (0.40) ALDH1A1LMNAKDM4ETP53

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-2231653-B1 ANTIBACTERIAL CONDENSED THIAZOLES BIOTA EUROPE LTD (GB) 2013-04-03 EP disclosed
US-8299065-B2 Antibacterial condensed thiazoles BIOTA EUROPE LTD. (GB) 2012-10-30 US disclosed
US-20100305067-A1 ANTIBACTERIAL CONDENSED THIAZOLES BIOTA EUROPE LTD (GB) 2010-12-02 US disclosed
EP-2231653-A1 ANTIBACTERIAL CONDENSED THIAZOLES Biota Europe Ltd (GB) 2010-09-29 EP disclosed
WO-2009074812-A1 ANTIBACTERIAL CONDENSED THIAZOLES PROLYSIS LTD (GB) 2009-06-18 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-20100305067-A1 ANTIBACTERIAL CONDENSED THIAZOLES NEK6, NEK1, TXK NOX4 238/4885CYBB 330/4885BRD4 478/4885

“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.