SCHEMBL16748593

SCHEMBL16748593

CCc1nc2c(F)cc(F)cc2n1-c1nc(N)nc(Nc2ccc(C)cc2)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYBB P04839 1/20 0.42
NOX5 Q96PH1 1/20 0.42
NOX3 Q9HBY0 1/20 0.42
NOX4 Q9NPH5 1/20 0.42
NOX1 Q9Y5S8 1/20 0.42
RAB9A P51151 7/20 0.42
NPC1 O15118 6/20 0.42
JAK2 O60674 1/20 0.42
MAPT P10636 3/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SMN1; SMN2 Q16637 7/20 0.40
AGPAT2 O15120 1/20 0.40
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 2/20 0.39
LMNA P02545 3/20 0.38
ADORA2A P29274 1/20 0.38

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
SCHEMBL16748421 0.92 AGPAT2 (0.41) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16748428 0.92 AGPAT2 (0.40) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16740864 0.90 BMI1 (0.48) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16748597 0.90 MAPT (0.44) RAB9ANPC1JAK2MAPTALDH1A1
SCHEMBL16748591 0.89 CYBB (0.44) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16748425 0.88 MAPK1 (0.36) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16740783 0.88 BMI1 (0.50) RAB9ANPC1JAK2MAPTHTT
SCHEMBL16748433 0.87 MAPT (0.46) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16748617 0.84 BMI1 (0.52) CYBBNOX5NOX3NOX4NOX1
SCHEMBL16740802 0.84 BMI1 (0.40) CYBBNOX5NOX3NOX4NOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US claimed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US claimed
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US disclosed
US-9975878-B2 Substituted triazine BMI-1 inhibitors PTC THERAPEUTICS, INC. (US) 2018-05-22 US disclosed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US disclosed
US-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS PTC THERAPEUTICS, INC. 2016-10-13 US disclosed
WO-2015076801-A1 SUBSTITUTED TRIAZINE 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-20160297798-A1 SUBSTITUTED TRIAZINE BMI-1 INHIBITORS BMI1, BAZ2A, BAZ2B CYBB 4251/4885NOX5 3227/4885NOX3 3963/4885

“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.