SCHEMBL10244136

SCHEMBL10244136

CN(C)c1ccc(CNc2nc(NCc3ccc(F)cc3)nc(Nc3cccc(C(F)(F)F)c3)n2)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDH2 P48735 9/20 0.60
APP P05067 3/20 0.57
KCNH3 Q9ULD8 3/20 0.54
SLC2A1 P11166 1/20 0.53
MAPT P10636 2/20 0.48
GAA P10253 1/20 0.48
LMNA P02545 2/20 0.48
MAPK1 P28482 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL10245089 0.91 APP (0.67) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL10244123 0.91 APP (0.67) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL13771742 0.89 IDH2 (0.71) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL10244160 0.88 IDH2 (0.62) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL10244162 0.88 APP (0.62) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL10245074 0.88 KCNH3 (0.67) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL1392500 0.87 IDH2 (0.55) IDH2APPSLC2A1MAPTGAA
SCHEMBL1390920 0.86 APP (0.61) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL10244437 0.85 APP (0.60) IDH2APPKCNH3SLC2A1MAPT
SCHEMBL1392072 0.85 IDH2 (0.62) IDH2APPKCNH3SLC2A1MAPT

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
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 US disclosed
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof HAVCR2, ZC3HAV1, MAVS IDH2 1936/4885APP 4146/4885KCNH3 3535/4885

“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.