SCHEMBL16740119

SCHEMBL16740119

CS(=O)(=O)c1ccc(Nc2cncc(-c3c(C(F)(F)F)nc4ccccn34)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.46
▸ CDK2 P24941 5/20 0.40
▸ CDK4 P11802 1/20 0.40
▸ FLT3 P36888 2/20 0.39
▸ PKM P14618 1/20 0.38
▸ NR1I3 Q14994 1/20 0.38
▸ IGF1R P08069 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ GAA P10253 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL16739997 0.86 PKM (0.46) CDK2FLT3PKMKDM4EMEN1
SCHEMBL16740355 0.86 PKM (0.51) CDK2FLT3PKMNR1I3KDM4E
SCHEMBL16740394 0.85 PKM (0.40) CDK2CDK4PKMIGF1RKDM4E
SCHEMBL16739602 0.85 PKM (0.41) PTGS2CDK2CDK4FLT3PKM
SCHEMBL16739550 0.85 IRAK4 (0.47) CDK2CDK4FLT3PKMKDM4E
SCHEMBL16739723 0.85 CDK2 (0.44) CDK2FLT3PKMNR1I3KDM4E
SCHEMBL16740196 0.85 PKM (0.49) PKMKDM4EMEN1ALDH1A1LMNA
SCHEMBL16739906 0.84 TUBB4A (0.49) PTGS2PKMKDM4EALDH1A1LMNA
SCHEMBL16740108 0.84 PKM (0.39) CDK2CDK4FLT3PKMNR1I3
SCHEMBL16740067 0.83 GAA (0.40) CDK2CDK4FLT3PKMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 PTGS2 4269/4885CDK2 1415/4885CDK4 1151/4885

“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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