SCHEMBL1392525

SCHEMBL1392525

CCOc1nc(Nc2cccc(C(F)(F)F)c2)nc(-c2ccc(C(C)(C)C)cc2)n1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
MAPT P10636 2/20 0.55
MAPK1 P28482 1/20 0.55
IDH2 P48735 6/20 0.50
RORC P51449 5/20 0.46
AURKA O14965 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
APP P05067 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL1392792 0.92 LMNA (0.55) LMNAMAPTMAPK1IDH2RORC
SCHEMBL1392411 0.91 MAPT (0.56) LMNAMAPTMAPK1IDH2AURKA
SCHEMBL1392892 0.91 MAPT (0.56) LMNAMAPTMAPK1IDH2AURKA
SCHEMBL1393019 0.91 LMNA (0.56) LMNAMAPTMAPK1IDH2RORC
SCHEMBL10245629 0.90 LMNA (0.58) LMNAMAPTMAPK1IDH2AURKA
SCHEMBL1392089 0.90 MAPT (0.55) LMNAMAPTMAPK1IDH2RORC
SCHEMBL1391914 0.90 LMNA (0.55) LMNAMAPTMAPK1IDH2RORC
SCHEMBL1392673 0.89 LMNA (0.50) LMNAMAPTMAPK1IDH2RORC
SCHEMBL1392185 0.89 LMNA (0.59) LMNAMAPTMAPK1IDH2AURKA
SCHEMBL1392394 0.89 LMNA (0.60) LMNAMAPTMAPK1IDH2RORC

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 LMNA 3218/4885MAPT 3654/4885MAPK1 2676/4885

“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.