SCHEMBL1392895

SCHEMBL1392895

FC(F)(F)COc1nc(Nc2cccc(C(F)(F)F)c2)nc(N2CCC2)n1

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.71
IDH2 P48735 13/20 0.70
USP2 O75604 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
APP P05067 1/20 0.53
LMNA P02545 4/20 0.53
MAPK1 P28482 1/20 0.53
MEN1 O00255 2/20 0.51
TSHR P16473 2/20 0.51
KMT2A Q03164 2/20 0.51
ALOX15 P16050 1/20 0.51
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL1392681 0.98 MAPT (0.75) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1392991 0.97 IDH2 (0.76) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1392191 0.97 IDH2 (0.76) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1391752 0.91 USP2 (0.68) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1391894 0.91 IDH2 (0.77) MAPTIDH2USP2SMN1; SMN2APP
Hydrochloric Acid SCHEMBL1391739 0.90 IDH2 (0.75) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1392745 0.88 MAPT (0.73) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1391436 0.88 MAPT (0.58) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1391661 0.88 IDH2 (0.74) MAPTIDH2USP2SMN1; SMN2APP
SCHEMBL1391823 0.88 IDH2 (0.74) MAPTIDH2USP2SMN1; SMN2APP

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 5 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
US-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof PROGENICS PHARMACEUTICALS, INC. (US) 2012-01-12 US disclosed
EP-2231624-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF Progenics Pharmaceuticals, Inc. (US) 2010-09-29 EP disclosed
WO-2009091388-A2 TRIAZINES AND RELATED COMPOUNDS HAVING ANTIVIRAL ACTIVITY, COMPOSITIONS AND METHODS THEREOF PROGENICS PHARMACEUTICALS, INC. (US) 2009-07-23 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-20120009151-A1 Triazines And Related Compounds Having Antiviral Activity, Compositions And Methods Thereof HAVCR2, ZC3HAV1, MAVS MAPT 3654/4885IDH2 1936/4885USP2 2047/4885

“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.