SCHEMBL17045005

SCHEMBL17045005

O=C(Nc1cc[nH]c(=O)c1)c1ccccc1F

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 12/20 0.65
SCN10A Q9Y5Y9 12/20 0.65
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
TDP1 Q9NUW8 1/20 0.61
MAPT P10636 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.57
PTPRC P08575 2/20 0.57
CTSL P07711 1/20 0.57
PTPN1 P18031 1/20 0.57
CTSS P25774 1/20 0.57
PTPN13 Q12923 1/20 0.57
LMNA P02545 1/20 0.56
JAK2 O60674 1/20 0.56
JAK1 P23458 1/20 0.56
TYK2 P29597 1/20 0.56

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
SCHEMBL15901791 0.84 SCN8A (0.65) SCN8ASCN10A
SCHEMBL15902052 0.83 SCN8A (0.69) SCN8ASCN10AJAK2JAK1TYK2
SCHEMBL28850189 0.82 KCNK3 (0.60) SCN8ASCN10APTPRCJAK2JAK1
SCHEMBL15907037 0.82 SCN10A (0.55) SCN8ASCN10A
SCHEMBL15901597 0.82 SCN8A (0.68) SCN8ASCN10A
SCHEMBL15907036 0.82 SCN10A (0.58) SCN8ASCN10A
SCHEMBL28064012 0.81 SCN8A (0.67) SCN8ASCN10AMAPT
SCHEMBL15901746 0.80 SCN8A (0.65) SCN8ASCN10AJAK2JAK1TYK2
SCHEMBL15901652 0.80 SCN10A (0.69) SCN8ASCN10A
SCHEMBL15901646 0.80 SCN10A (0.72) SCN8ASCN10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108164457-A Pyridine keto-amide as sodium channel modulators 沃泰克斯药物股份有限公司 2018-06-15 CN disclosed
CN-105026373-B Pyridone amides as sodium channel modulators 沃泰克斯药物股份有限公司 2018-03-30 CN disclosed
US-9393235-B2 Pyridone amides as modulators of sodium channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2016-07-19 US disclosed
US-20150246028-A1 PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2015-09-03 US 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-20150246028-A1 PYRIDONE AMIDES AS MODULATORS OF SODIUM CHANNELS SCN5A, SCN1A, KCNJ2 SCN8A 77/4885SCN10A 12/4885MEN1 2606/4885

“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.