SCHEMBL16740322

SCHEMBL16740322

Cc1nc2c(F)cc(F)cc2n1-c1cc(C#N)cc(Nc2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BMI1 P35226 8/20 0.44
DHODH Q02127 2/20 0.36
GALR2 O43603 1/20 0.36
TRPV1 Q8NER1 1/20 0.35
EGFR P00533 1/20 0.34
PDGFRB P09619 1/20 0.34
KDR P35968 1/20 0.34
AGPAT2 O15120 1/20 0.34
CSNK1D P48730 1/20 0.34
CSNK1G2 P78368 1/20 0.34
IDH1 O75874 1/20 0.34
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33

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
SCHEMBL16740177 0.89 BMI1 (0.42) BMI1DHODHGALR2TRPV1AGPAT2
SCHEMBL16740388 0.88 IDH1 (0.40) DHODHGALR2IDH1CTSSCTSK
SCHEMBL16740363 0.85 BMI1 (0.61) BMI1DHODHGALR2EGFRPDGFRB
SCHEMBL16740164 0.85 BMI1 (0.47) BMI1GALR2TRPV1KDRIDH1
SCHEMBL18100916 0.85 BMI1 (0.46) BMI1DHODHGALR2TRPV1EGFR
SCHEMBL16739963 0.84 BMI1 (0.48) BMI1DHODHGALR2TRPV1EGFR
SCHEMBL16740176 0.84 BMI1 (0.47) BMI1GALR2IDH1ABCG2
SCHEMBL16747820 0.83 BMI1 (0.51) BMI1DHODHGALR2EGFRPDGFRB
SCHEMBL16747902 0.81 BMI1 (0.58) BMI1DHODHABCG2
SCHEMBL16748005 0.81 BMI1 (0.46) BMI1DHODHGALR2TRPV1AGPAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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 3196/4885GALR2 4615/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B BMI1 1/4885DHODH 3196/4885GALR2 4615/4885

“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.