SCHEMBL16740316

SCHEMBL16740316

Cc1nc2ncccc2n1-c1cncc(Nc2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.49
SCN5A Q14524 4/20 0.49
SCN9A Q15858 4/20 0.49
BRAF P15056 1/20 0.42
ABL1 P00519 8/20 0.41
BCR P11274 8/20 0.41
DHODH Q02127 1/20 0.39
DHFR P00374 1/20 0.37
BMI1 P35226 5/20 0.37

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
SCHEMBL16740326 0.87 BMI1 (0.49) KCNH2SCN5ASCN9AABL1BCR
SCHEMBL16740380 0.86 BMI1 (0.52) KCNH2SCN5ASCN9ADHFRBMI1
SCHEMBL16739749 0.85 BMI1 (0.53) KCNH2SCN5ASCN9ABRAFDHFR
SCHEMBL16740249 0.85 KCNH2 (0.47) KCNH2SCN5ASCN9ABRAFABL1
SCHEMBL16740293 0.81 TRPV1 (0.37) DHODHBMI1
SCHEMBL16739623 0.80 KCNH2 (0.51) KCNH2SCN5ASCN9ABRAFABL1
SCHEMBL16740257 0.79 KCNH2 (0.50) KCNH2SCN5ASCN9ABRAFABL1
SCHEMBL16740062 0.79 KCNH2 (0.50) KCNH2SCN5ASCN9ABRAFABL1
SCHEMBL16739937 0.78 KCNH2 (0.49) KCNH2SCN5ASCN9ABRAFABL1
SCHEMBL18094403 0.78 KCNH2 (0.49) KCNH2SCN5ASCN9ABRAFABL1

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
EP-3071553-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC Therapeutics, Inc. (US) 2016-09-28 EP claimed
WO-2015076800-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 WO claimed
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 KCNH2 3952/4885SCN5A 3115/4885SCN9A 4295/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B KCNH2 3952/4885SCN5A 3115/4885SCN9A 4295/4885

“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.