SCHEMBL793224

SCHEMBL793224

N#Cc1cc(F)cc(Cl)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KHK P50053 1/20 0.43
ALDH1A1 P00352 2/20 0.36
CYP3A4 P08684 2/20 0.36
TRPV4 Q9HBA0 3/20 0.35
CYP11B2 P19099 4/20 0.34
CSNK1A1 P48729 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
XDH P47989 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PGK1 P00558 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL2435542 0.78 CYP3A4 (0.56) KHKALDH1A1CYP3A4TRPV4CSNK1A1
SCHEMBL165074 0.78 GPR35 (0.41) KHKALDH1A1CYP3A4TRPV4CSNK1A1
SCHEMBL29421236 0.78 GPR35 (0.41) KHKALDH1A1CYP3A4TRPV4CSNK1A1
SCHEMBL30107963 0.78 TRPV4 (0.38) KHKALDH1A1TRPV4CYP11B2KDM4E
SCHEMBL2652439 0.78 ADRB2 (0.44) KHKALDH1A1TRPV4CYP11B2ADRB2
SCHEMBL9844450 0.78 TRPV4 (0.38) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL7922013 0.78 TRPV4 (0.38) KHKALDH1A1TRPV4CYP11B2KDM4E
SCHEMBL631036 0.78 KHK (0.37) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL11028824 0.77 CYP3A4 (0.37) KHKALDH1A1CYP3A4TRPV4CYP11B2
SCHEMBL1951099 0.77 CYP3A4 (0.58) ALDH1A1CYP3A4ADRB1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4141006-A1 NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA Novartis AG (CH) 2023-03-01 EP disclosed
EP-4141006-A1 NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA Novartis AG (CH) 2023-03-01 EP disclosed
US-11530213-B2 Naphthyridinone derivatives and their use in the treatment of arrhythmia NOVARTIS AG (CH) 2022-12-20 US disclosed
US-11530213-B2 Naphthyridinone derivatives and their use in the treatment of arrhythmia NOVARTIS AG (CH) 2022-12-20 US disclosed
EP-3529251-B1 NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA NOVARTIS AG (CH) 2022-10-05 EP disclosed
EP-3529251-B1 NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA NOVARTIS AG (CH) 2022-10-05 EP disclosed
CN-109843887-B Nalidinone derivatives and their use in the treatment of cardiac arrhythmias 诺华股份有限公司 2022-05-10 CN disclosed
US-20210284635-A1 NOVEL NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA NOVARTIS AG (CH) 2021-09-16 US disclosed
US-20210284635-A1 NOVEL NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA NOVARTIS AG (CH) 2021-09-16 US disclosed
US-10844055-B2 Naphthyridinone derivatives and their use in the treatment of arrhythmia NOVARTIS AG (CH) 2020-11-24 US disclosed
US-8697708-B2 Azabenzothiazole compounds, compositions and methods of use F. HOFFMANN-LA ROCHE AG (CH) 2014-04-15 US disclosed
US-20130252941-A1 PYRAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2013-09-26 US disclosed
US-20130252941-A1 PYRAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2013-09-26 US disclosed
US-20130252941-A1 PYRAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2013-09-26 US disclosed
EP-2640722-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIDINES AND THEIR USE AS TYK2 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2013-09-25 EP disclosed
EP-2616072-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F.HOFFMANN-LA ROCHE AG (CH) 2013-07-24 EP disclosed
US-20120202788-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-08-09 US disclosed
WO-2012066061-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIDINES AND THEIR USE AS TYK2 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-05-24 WO disclosed
WO-2012066061-A1 PYRAZOLOPYRIDINES AND PYRAZOLOPYRIDINES AND THEIR USE AS TYK2 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2012-05-24 WO disclosed
WO-2012035039-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F. HOFFMANN-LA ROCHE AG (CH) 2012-03-22 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 (5 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-20130252941-A1 PYRAZOLOPYRIDINE COMPOUNDS, COMPOSITIONS AND METHODS OF USE P2RX5, P2RX4, P2RY1 KHK 2129/4885ALDH1A1 1091/4885CYP3A4 73/4885
US-20210284635-A1 NOVEL NAPHTHYRIDINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF ARRHYTHMIA SCN1B, SCN3A, SCN5A KHK 2973/4885ALDH1A1 1241/4885CYP3A4 407/4885
US-10844055-B2 Naphthyridinone derivatives and their use in the treatment of arrhythmia SCN1B, NPR3, SCN3A KHK 2188/4885ALDH1A1 1493/4885CYP3A4 281/4885
US-11530213-B2 Naphthyridinone derivatives and their use in the treatment of arrhythmia SCN1B, NPR3, SCN3A KHK 2188/4885ALDH1A1 1493/4885CYP3A4 281/4885
US-20120202788-A1 AZABENZOTHIAZOLE COMPOUNDS, COMPOSITIONS AND METHODS OF USE F12, CHRM1, NPY1R KHK 3068/4885ALDH1A1 1372/4885CYP3A4 33/4885

“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.