SCHEMBL16747856

SCHEMBL16747856

Fc1ccc2nc(C(F)(F)F)c(-c3cccc(Nc4ccc(C(F)(F)F)cc4)n3)n2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 2/20 0.37
▸ TP53 P04637 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ TRPA1 O75762 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ ABCG2 Q9UNQ0 2/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ ACP1 P24666 1/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ CYP11B2 P19099 1/20 0.34
▸ APP P05067 1/20 0.34
▸ KARS1 Q15046 2/20 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
SCHEMBL16747969 0.88 USP7 (0.41) PKMTP53GAAMAPTNPY5R
SCHEMBL16740229 0.86 KCNH2 (0.42) PKMCYP11B1CYP11B2BMI1FADS1
SCHEMBL18094384 0.86 ROCK1 (0.39) TP53GAAMAPTMEN1CYP1A2
SCHEMBL16740069 0.85 ACP1 (0.45) PKMTP53GAAMAPTMEN1
SCHEMBL16747808 0.84 PKM (0.50) PKMTP53GAAMAPTMEN1
SCHEMBL16747921 0.84 AGPAT2 (0.38) PKMTRPA1DHODHABCG2CYP11B1
SCHEMBL16740278 0.83 PKM (0.33) PKMTP53GAATRPA1MAPT
SCHEMBL16739922 0.83 AGPAT2 (0.35) PKMTRPA1DHODHCYP11B1CYP11B2
SCHEMBL16747868 0.83 KCNH3 (0.34) PKMDHODHCYP11B1CYP11B2GPR139
SCHEMBL16740159 0.83 TRPA1 (0.39) PKMTRPA1DHODHABCG2CYP11B1

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-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 PKM 4004/4885TP53 921/4885GAA 4374/4885
US-10584115-B2 Substituted pyridine and pyrazine BMI-1 inhibitors BMI1, BAZ2A, BAZ2B PKM 4004/4885TP53 921/4885GAA 4374/4885

“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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