SCHEMBL1391666

SCHEMBL1391666

CCOc1nc(Nc2cccc(C(F)(F)F)c2)nc(N2CCOCC2)n1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.70
USP2 O75604 2/20 0.70
KMT2A Q03164 3/20 0.63
MEN1 O00255 2/20 0.63
MAPT P10636 5/20 0.60
IDH2 P48735 6/20 0.59
HSD17B10 Q99714 1/20 0.56
PIK3CA P42336 1/20 0.55
TP53 P04637 1/20 0.54
POLB P06746 1/20 0.54
MTOR P42345 1/20 0.52
SMG1 Q96Q15 1/20 0.52
MAPK1 P28482 2/20 0.52
LMNA P02545 1/20 0.52
NPSR1 Q6W5P4 1/20 0.51
CTSL P07711 1/20 0.50
CTSB P07858 1/20 0.50
CTSS P25774 1/20 0.50
CTSK P43235 1/20 0.50

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
SCHEMBL1392745 0.91 MAPT (0.73) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL1391661 0.90 IDH2 (0.74) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL1391823 0.90 IDH2 (0.74) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL1392467 0.89 USP2 (0.68) SMN1; SMN2USP2MAPTIDH2MAPK1
SCHEMBL1392169 0.88 MAPT (0.60) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL1391514 0.88 MAPT (0.57) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL1391564 0.87 MAPT (0.59) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL3758998 0.86 USP2 (0.87) SMN1; SMN2USP2KMT2AMEN1MAPT
SCHEMBL30568813 0.86 USP2 (0.83) SMN1; SMN2USP2KMT2AMAPTIDH2
SCHEMBL1392012 0.85 USP2 (0.54) SMN1; SMN2USP2KMT2AMEN1MAPT

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 4 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
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 SMN1; SMN2 4526/4885USP2 2047/4885KMT2A 4066/4885

“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.