SCHEMBL2489374

SCHEMBL2489374

CSc1nc(=O)c2cc(C(F)(F)F)cc([N+](=O)[O-])c2s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 4/20 0.49
▸ PLK1 P53350 4/20 0.45
▸ KCNH2 Q12809 2/20 0.45
▸ CYP3A4 P08684 5/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ HIF1A Q16665 1/20 0.41
▸ TXNRD1 Q16881 1/20 0.41
▸ TXNRD3 Q86VQ6 1/20 0.41
▸ TXNRD2 Q9NNW7 1/20 0.41
▸ MAPT P10636 3/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.39
▸ PTPN5 P54829 1/20 0.39
▸ CYP1A2 P05177 2/20 0.39
▸ CYP2D6 P10635 2/20 0.39
▸ MAPK1 P28482 2/20 0.38
▸ CYP2C9 P11712 1/20 0.35

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
SCHEMBL2488807 0.88 CYP2C19 (0.50) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL10034408 0.84 CYP2C19 (0.52) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL28411478 0.82 MAPT (0.37) ALDH1A1TSHRTDP1HPGDTXNRD1
SCHEMBL18517038 0.81 CYP2C19 (0.50) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL2486931 0.81 TOP2A (0.33) CYP2C19HPGD
SCHEMBL2489377 0.80 TOP2A (0.33) CYP2C19
SCHEMBL21226008 0.79 CYP2C19 (0.50) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL2890931 0.78 KCNH2 (0.50) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL28496780 0.78 PLK1 (0.47) CYP2C19PLK1KCNH2CYP3A4ALDH1A1
SCHEMBL2492296 0.75 CYP2C19 (0.69) CYP2C19KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011132070-A1 PROCESS FOR THE PREPARATION OF 2-AMINO-SUBSTITUTED 1,3-BENZOTHIAZINE-4-ONES MAKAROV VADIM A (RU) 2011-10-27 — — WO claimed
EP-2380886-A1 Process for the preparation of 2-aminosubstituted 1,3-benzothiazine-4-ones Makarov Vadim A. (RU) 2011-10-26 — — EP claimed
WO-2025032611-A1 BENZO[de]ISOQUINOLINE-1,3-DIONE BASED COMPOUND AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2025-02-13 — — WO disclosed
CN-108440446-B Benzothiazine-4-ketone compound containing oximino fragment and preparation method thereof 中国医学科学院医药生物技术研究所 2020-05-15 — — CN disclosed
EP-2640712-B1 2-PIPERAZIN-1-YL-4H-1,3-BENZOTHIAZIN-4-ONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS ECOLE POLYTECHNIQUE FED LAUSANNE EPFL (CH) 2018-07-11 — — EP disclosed
US-8796264-B2 2-piperazin-1-yl-4H-1,3-benzothiazin-4-one derivatives and their use for the treatment of mammalian infections ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2014-08-05 — — US disclosed
EP-2640712-A1 2-PIPERAZIN-1-YL-4H-1,3-BENZOTHIAZIN-4-ONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS Ecole Polytechnique Fédérale de Lausanne (EPFL) (CH) 2013-09-25 — — EP disclosed
US-20130245007-A1 2-PIPERAZIN-1-YL-4H-1,3-BENZOTHIAZIN-4-ONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2013-09-19 — — US disclosed
WO-2013038259-A1 BENZOTHIAZINONE DERIVATIVES AS ANTI -TUBERCULOSIS AGENTS THE UNIVERSITY OF QUEENSLAND (AU) 2013-03-21 — — WO disclosed
EP-2570413-A1 Benzothiazinone derivatives as anti-tuberculosis agents The University Of Queensland (AU) 2013-03-20 — — EP disclosed
WO-2012085654-A1 NOVEL ANTI-TUBERCULOSIS AGENTS THE UNIVERSITY OF QUEENSLAND (AU) 2012-06-28 — — WO disclosed
EP-2468746-A1 Benzothiazinone compounds and their use as anti-tuberculosis agents The University of Queensland (AU) 2012-06-27 — — EP disclosed
WO-2012066518-A1 2-PIPERAZIN-1-YL-4H-1,3-BENZOTHIAZIN-4-ONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2012-05-24 — — WO disclosed
EP-2380886-A1 Process for the preparation of 2-aminosubstituted 1,3-benzothiazine-4-ones Makarov Vadim A. (RU) 2011-10-26 — — EP 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-20130245007-A1 2-PIPERAZIN-1-YL-4H-1,3-BENZOTHIAZIN-4-ONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF MAMMALIAN INFECTIONS BPGM, TBC1D5, TBC1D15 CYP2C19 2625/4885PLK1 4097/4885KCNH2 4072/4885

“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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