SCHEMBL16740043

SCHEMBL16740043

FC(F)(F)c1nc2ncccn2c1-c1cccc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ GAA P10253 5/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ GABRA1 P14867 4/20 0.37
▸ GABRG2 P18507 4/20 0.37
▸ GABRB3 P28472 4/20 0.37
▸ GABRA3 P34903 4/20 0.37
▸ KLK7 P49862 1/20 0.37
▸ MAPT P10636 5/20 0.35
▸ LMNA P02545 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ PKM P14618 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34

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
SCHEMBL16739977 0.83 KDM4E (0.41) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL18100941 0.80 MAPT (0.50) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16740008 0.78 HSD17B10 (0.41) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16747972 0.77 PKM (0.53) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16748003 0.73 ALDH1A1 (0.43) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16739626 0.72 ROCK1 (0.43) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16739848 0.69 ALDH1A1 (0.50) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL16740003 0.68 PKM (0.53) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL13377062 0.65 KDM4E (0.55) KDM4EALDH1A1HPGDGAARAB9A
SCHEMBL29893700 0.65 KLK7 (0.41) KDM4EALDH1A1HPGDGAARAB9A

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 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
EP-3071553-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC Therapeutics, Inc. (US) 2016-09-28 — — EP disclosed
WO-2015076800-A1 SUBSTITUTED PYRIDINE AND PYRAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. (US) 2015-05-28 — — WO 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 KDM4E 102/4885ALDH1A1 1727/4885HPGD 4481/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B KDM4E 102/4885ALDH1A1 1727/4885HPGD 4481/4885

“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.

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