SCHEMBL10312126

SCHEMBL10312126

C/C=C/c1cc(Nc2nc(/C=C/c3cccc(C(F)(F)F)c3)nc(N(C)C)n2)n[nH]1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 3/20 0.47
HRH4 Q9H3N8 1/20 0.37
NFE2L2 Q16236 1/20 0.37
MELK Q14680 1/20 0.34
CTSC P53634 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
IGF1R P08069 1/20 0.31
FBP1 P09467 1/20 0.31

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
SCHEMBL10312181 0.89 IDH2 (0.48) IDH2HRH4NFE2L2MELKIGF1R
SCHEMBL10312203 0.88 FLT3 (0.38) IDH2HRH4NFE2L2
SCHEMBL10312114 0.86 HRH4 (0.34) IDH2HRH4KMT2ALMNA
SCHEMBL10312192 0.85 IGF1R (0.46) IDH2HRH4MEN1KMT2AIGF1R
SCHEMBL16556933 0.82 HRH4 (0.51) IDH2HRH4MAPT
SCHEMBL10312133 0.82 NTRK1 (0.39) IDH2HRH4NFE2L2IGF1R
SCHEMBL10312234 0.81 HRH4 (0.61) IDH2HRH4CTSCMAPT
SCHEMBL10312230 0.81 IDH2 (0.52) IDH2HRH4CTSCKMT2AMAPT
SCHEMBL10312098 0.81 IDH2 (0.37) IDH2HRH4NFE2L2
SCHEMBL10312231 0.80 HRH4 (0.49) IDH2HRH4KMT2ALMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY, LLC (US) 2012-07-12 US 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-20120178758-A1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS STK25, STK35, SGK2 IDH2 745/4885HRH4 2393/4885NFE2L2 1235/4885

“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.