SCHEMBL16747809

SCHEMBL16747809

Cc1nc2cc(F)c(F)cc2n1-c1cncc(Nc2ccc(C(F)(F)F)c(F)c2)n1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BMI1 P35226 7/20 0.42
DHODH Q02127 1/20 0.38
CYP11B2 P19099 5/20 0.36
CYP11B1 P15538 3/20 0.36
BUB1 O43683 2/20 0.34
BCDIN3D Q7Z5W3 1/20 0.33
KCNH2 Q12809 1/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
DHFR P00374 1/20 0.32

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
SCHEMBL16740417 0.89 BMI1 (0.50) BMI1DHODHCYP11B2CYP11B1
SCHEMBL16747858 0.88 BMI1 (0.55) BMI1DHODHKCNH2SCN5ASCN9A
SCHEMBL29820520 0.88 BMI1 (0.55) BMI1DHODHKCNH2SCN5ASCN9A
SCHEMBL16747981 0.85 RAPGEF4 (0.38) BMI1BUB1DHFR
SCHEMBL16740184 0.85 BMI1 (0.38) BMI1BUB1KCNH2SCN5ASCN9A
SCHEMBL16739727 0.85 BMI1 (0.45) BMI1BUB1KCNH2SCN5ASCN9A
SCHEMBL16740339 0.85 BMI1 (0.43) BMI1BUB1KCNH2
SCHEMBL16739732 0.84 BMI1 (0.39) BMI1DHODHCYP11B2CYP11B1BUB1
SCHEMBL16740163 0.83 ABCG2 (0.37) BMI1DHODH
SCHEMBL16739582 0.83 KCNH2 (0.41) BMI1BUB1KCNH2SCN5ASCN9A

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 6 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-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 BMI1 1/4885DHODH 3196/4885CYP11B2 4388/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B BMI1 1/4885DHODH 3196/4885CYP11B2 4388/4885

“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.