SCHEMBL2889294

SCHEMBL2889294

CC(O)(C(N)=O)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 14/20 0.38
PDK2 Q15119 14/20 0.38
PDK3 Q15120 14/20 0.38
PDK4 Q16654 14/20 0.38
ABCC9 O60706 1/20 0.35
ABCC8 Q09428 1/20 0.35
KCNJ11 Q14654 1/20 0.35
KCNJ8 Q15842 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
SCHEMBL3896419 1.00 PDK1 (0.38) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL3897596 1.00 PDK1 (0.38) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL13792298 0.78
SCHEMBL13967284 0.75 ALDH1A1 (0.37)
SCHEMBL569205 0.75 ALDH1A1 (0.53) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL568924 0.75 ALDH1A1 (0.53) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL568925 0.75 ALDH1A1 (0.53) PDK1PDK2PDK3PDK4ABCC9
SCHEMBL622355 0.74
SCHEMBL435447 0.74
SCHEMBL9722984 0.73 LMNA (0.33)

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 178 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11911371-B2 Pyridine and pyrazine derivative for the treatment of chronic bronchitis NOVARTIS AG (CH) 2024-02-27 US claimed
US-20240058315-A1 Pyridine and Pyrazine derivative for the Treatment of CF, COPD, and Bronchiectasis NOVARTIS AG (CH) 2024-02-22 US claimed
CN-113891744-A Pyridine and pyrazine derivatives for the treatment of CF, COPD and bronchiectasis 诺华股份有限公司 2022-01-04 CN claimed
US-20210228554-A1 Pyridine and Pyrazine Derivative for the Treatment of CF NOVARTIS AG (CH) 2021-07-29 US claimed
WO-2020250116-A1 PYRIDINE AND PYRAZINE DERIVATIVE FOR THE TREATMENT OF CF, COPD, AND BRONCHIECTASIS NOVARTIS AG (CH) 2020-12-17 WO claimed
US-20200383960-A1 Pyridine and Pyrazine derivative for the Treatment of CF, COPD, and Bronchiectasis NOVARTIS AG (CH) 2020-12-10 US claimed
US-10117858-B2 Pyridine and pyrazine derivative for the treatment of CF NOVARTIS AG (CH) 2018-11-06 US claimed
US-RE46757-E1 Pyridine and pyrazine derivative for the treatment of CF NOVARTIS AG (CH) 2018-03-20 US claimed
EP-2845593-B1 Pyridine and pyrazine derivative for the treatment of chronic obstructive pulmonary disease NOVARTIS AG (CH) 2017-01-25 EP claimed
US-9365552-B2 Pyridine and pyrazine derivative for the treatment of CF NOVARTIS AG (CH) 2016-06-14 US claimed
EP-1372630-A4 AGENT FOR THE TREATMENT OF OVERACTIVE BLADDER KYOWA HAKKO KOGYO KK (JP) 2005-03-23 EP claimed
US-6773910-B1 VIA MICROORGANISM (ARTHROBACTER, BACILLUS, KLEBSIELLA, AND PSEUDOMONAS) WHICH UTILIZES PROPIONIC ACID AMIDE COMPOUND AS SOLE NITROGEN SOURCE LONZA AG (CH) 2004-08-10 US claimed
EP-1372639-A2 AGENT FOR THE TREATMENT OF BLADDER IRRITATIVE SYMPTOMS ACCOMPANIED BY BENIGN PROSTATIC HYPERPLASIA KYOWA HAKKO KOGYO CO., LTD. (JP) 2004-01-02 EP claimed
EP-1372630-A2 AGENT FOR THE TREATMENT OF OVERACTIVE BLADDER Kyowa Hakko Kogyo Co., Ltd (JP) 2004-01-02 EP claimed
US-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor ASTRAZENECA AB (SE) 2003-12-04 US claimed
US-20030087402-A1 Process for the preparation of (S) - or (R) -3,3,3-trifluoro-2-hydroxy-2-methylpropionic acid BRIEDEN WALTER (CH) 2003-05-08 US claimed
EP-1278739-A1 AMINO SUBSTITUTED DIBENZOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY THE NP Y5 RECEPTOR AstraZeneca AB (SE) 2003-01-29 EP claimed
WO-2002078523-A2 AGENT FOR THE TREATMENT OF OVERACTIVE BLADDER KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-10-10 WO claimed
WO-2002078633-A2 AGENT FOR THE TREATMENT OF BLADDER IRRITATIVE SYMPTOMS ACCOMPANIED BY BENIGN PROSTATIC HYPERPLASIA KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-10-10 WO claimed
WO-2001085714-A1 AMINO SUBSTITUTED DIBENZOTHIOPHENE DERIVATIVES FOR THE TREATMENT OF DISORDERS MEDIATED BY THE NP Y5 RECEPTOR ASTRAZENECA AB (SE) 2001-11-15 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20210228554-A1 Pyridine and Pyrazine Derivative for the Treatment of CF CFTR, OPRK1, OPRD1 PDK1 475/4885PDK2 1141/4885PDK3 1447/4885
US-20200383960-A1 Pyridine and Pyrazine derivative for the Treatment of CF, COPD, and Bronchiectasis CFTR, OPRK1, CHRM3 PDK1 332/4885PDK2 767/4885PDK3 853/4885
US-10117858-B2 Pyridine and pyrazine derivative for the treatment of CF CFTR, OPRK1, OPRD1 PDK1 475/4885PDK2 1141/4885PDK3 1447/4885
US-11911371-B2 Pyridine and pyrazine derivative for the treatment of chronic bronchitis CFTR, OPRK1, CHRM3 PDK1 305/4885PDK2 908/4885PDK3 1086/4885
US-20240058315-A1 Pyridine and Pyrazine derivative for the Treatment of CF, COPD, and Bronchiectasis CFTR, OPRK1, CHRM3 PDK1 332/4885PDK2 767/4885PDK3 853/4885
US-20030225097-A1 Amino substituted dibenzothiophene derivatives for the treatment of disorders mediated by np y5 receptor NPY5R, NPY1R, NPY2R PDK1 4120/4885PDK2 3798/4885PDK3 3558/4885

“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.