SCHEMBL1391817

SCHEMBL1391817

O=C(Nc1ccccc1)c1ccc(-c2nc(NCc3ccc(F)cc3)nc(OCC(F)(F)F)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 17/20 0.51
TCF7L2 Q9NQB0 17/20 0.51
LMNA P02545 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
HDAC4 P56524 1/20 0.45
MAPT P10636 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL1391397 0.95 CTNNB1 (0.49) CTNNB1TCF7L2
SCHEMBL1391517 0.90 CNR2 (0.49) CTNNB1TCF7L2LMNAMAPTSMN1; SMN2
SCHEMBL1391417 0.89 CTNNB1 (0.50) CTNNB1TCF7L2HDAC4
SCHEMBL1391394 0.88 PTGS2 (0.55) CTNNB1TCF7L2
SCHEMBL1391678 0.88 MAPT (0.46) CTNNB1TCF7L2LMNAMEN1KMT2A
SCHEMBL1392146 0.86 CNR2 (0.50) CTNNB1TCF7L2MEN1KMT2AMAPT
SCHEMBL1391347 0.86 MAPT (0.57) LMNAMEN1KMT2AMAPTSMN1; SMN2
SCHEMBL1391366 0.83 TP53 (0.44) CTNNB1TCF7L2LMNAHDAC4MAPT
SCHEMBL1392091 0.81 RORC (0.49) MAPT
SCHEMBL1391317 0.81 CTNNB1 (0.48) CTNNB1TCF7L2MAPT

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 CTNNB1 2636/4885TCF7L2 251/4885LMNA 3218/4885

“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.