SCHEMBL16747810

SCHEMBL16747810

CNc1nc2ccccc2n1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 2/20 0.50
SCN9A Q15858 2/20 0.50
KCNH2 Q12809 1/20 0.50
IDH1 O75874 6/20 0.48
BRAF P15056 1/20 0.43
BMI1 P35226 9/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL16740223 0.92 SCN9A (0.43) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16739749 0.88 BMI1 (0.53) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16740199 0.87 BMI1 (0.55) SCN5ASCN9AKCNH2BMI1MAPT
SCHEMBL16747908 0.86 BMI1 (0.57) SCN5ASCN9AIDH1BMI1NPC1
SCHEMBL16740093 0.85 SCN5A (0.49) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16739616 0.83 SCN9A (0.49) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16740257 0.80 KCNH2 (0.50) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16747892 0.79 BMI1 (0.54) SCN5ASCN9AKCNH2BMI1
SCHEMBL18094403 0.79 KCNH2 (0.49) SCN5ASCN9AKCNH2IDH1BRAF
SCHEMBL16740112 0.79 BMI1 (0.50) SCN5ASCN9AIDH1BMI1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2020-03-10 US claimed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 US claimed
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2020-03-10 US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 US disclosed
US-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-09-29 US disclosed
WO-2015076800-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 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 (2 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-20160280685-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B SCN5A 3115/4885SCN9A 4295/4885KCNH2 3952/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B SCN5A 3115/4885SCN9A 4295/4885KCNH2 3952/4885

“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.