SCHEMBL10312098

SCHEMBL10312098

C/C=C/c1cc(Nc2nc(/C=C/c3cccc(C(F)(F)F)c3)nc(Nc3ccc(P(C)(C)=O)cc3)n2)n[nH]1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 5/20 0.37
APP P05067 3/20 0.36
ABL1 P00519 1/20 0.34
SRC P12931 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
DHODH Q02127 1/20 0.34
HTT P42858 1/20 0.34
THRB P10828 1/20 0.34
NFE2L2 Q16236 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
SCHEMBL10312077 0.90 DHODH (0.46) IDH2APPABL1SRCHRH4
SCHEMBL10312100 0.89 AURKA (0.32) ABL1SRCHRH4HTTNFE2L2
SCHEMBL10312136 0.88 PTGS2 (0.35) ABL1SRCHRH4
SCHEMBL10312178 0.86 CCNA2 (0.45) SRC
SCHEMBL10312126 0.81 IDH2 (0.47) IDH2HRH4NFE2L2
SCHEMBL10312133 0.80 NTRK1 (0.39) IDH2ABL1HRH4L3MBTL1NFE2L2
SCHEMBL10312129 0.79 KDM4E (0.41) IDH2HTT
SCHEMBL10312219 0.78 AURKA (0.41) ABL1SRCDHODH
SCHEMBL16556933 0.78 HRH4 (0.51) IDH2APPHRH4
SCHEMBL10312096 0.78 MELK (0.34) IDH2HRH4L3MBTL1NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440055-B1 STYRYL-TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS CALIFORNIA CAPITAL EQUITY LLC (US) 2015-03-11 EP disclosed
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 745/4885APP 2830/4885ABL1 132/4885

“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.