SCHEMBL1392091

SCHEMBL1392091

O=C(Nc1ccc(F)cc1)c1ccc(-c2nc(Nc3cccc(C(F)(F)F)c3)nc(OCC(F)(F)F)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RORC P51449 9/20 0.49
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
MAPK1 P28482 1/20 0.49
AURKA O14965 2/20 0.48
NPSR1 Q6W5P4 1/20 0.47
APP P05067 1/20 0.47
BTK Q06187 5/20 0.47
LCK P06239 2/20 0.46
SYK P43405 1/20 0.46
BLK P51451 1/20 0.46

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
SCHEMBL1392484 0.94 AURKA (0.55) RORCKDM4EMAPTMAPK1AURKA
SCHEMBL1392300 0.92 AURKA (0.51) KDM4EMAPTMAPK1AURKANPSR1
SCHEMBL1391943 0.90 LMNA (0.54) KDM4EMAPTMAPK1AURKAAPP
SCHEMBL1392674 0.87 RORC (0.61) RORCMAPTMAPK1
SCHEMBL1392094 0.86 AURKA (0.58) KDM4EMAPTMAPK1AURKANPSR1
SCHEMBL1392013 0.85 RORC (0.58) RORCKDM4EMAPTMAPK1AURKA
SCHEMBL1392347 0.84 LMNA (0.54) RORCMAPTMAPK1AURKA
SCHEMBL1392402 0.83 BTK (0.47) MAPTMAPK1AURKAAPPBTK
SCHEMBL1392287 0.83 MAPT (0.46) RORCMAPTMAPK1AURKABTK
SCHEMBL1392440 0.83 LMNA (0.49) RORCMAPTMAPK1AURKA

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 RORC 116/4885KDM4E 3281/4885MAPT 3654/4885

“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.