SCHEMBL16748575

SCHEMBL16748575

Nc1nc(Nc2ccc(OC(F)F)cc2)nc(-n2c(C3CC3)nc3ncc(F)cc32)n1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BMI1 P35226 10/20 0.47
ROCK1 Q13464 1/20 0.38
GALR2 O43603 3/20 0.36
GRM5 P41594 1/20 0.35
DHFR P00374 1/20 0.35
GALR1 P47211 1/20 0.34
SYK P43405 2/20 0.33
IDH1 O75874 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL15742416 0.87 BMI1 (0.46) BMI1ROCK1GALR2GRM5DHFR
SCHEMBL16748497 0.87 BMI1 (0.51) BMI1ROCK1GALR2GALR1IDH1
SCHEMBL16748504 0.87 BMI1 (0.52) BMI1ROCK1GALR2GALR1IDH1
SCHEMBL16740744 0.86 BMI1 (0.45) BMI1ROCK1GALR2GRM5GALR1
SCHEMBL15742643 0.86 BMI1 (0.53) BMI1ROCK1GALR2GRM5DHFR
SCHEMBL16748578 0.85 BMI1 (0.52) BMI1ROCK1GALR2GRM5DHFR
SCHEMBL16740814 0.85 BMI1 (0.51) BMI1MAPT
SCHEMBL16748494 0.84 BMI1 (0.50) BMI1ROCK1GALR2DHFRGALR1
SCHEMBL16748580 0.83 BMI1 (0.52) BMI1ROCK1DHFRSYKALDH1A1
SCHEMBL16740842 0.82 BMI1 (0.66) BMI1ROCK1GALR2IDH1MAPT

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 9 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-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
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 BMI1 1/4885ROCK1 2999/4885GALR2 4541/4885

“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.