SCHEMBL2591561

SCHEMBL2591561

Cc1cc(C)c(CNC(=O)c2cc(-c3ccc(F)cc3)cc3c2c(C)nn3C(C)C)c(=O)[nH]1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 18/20 0.61
HDAC1 Q13547 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
EZH1 Q92800 2/20 0.52
EED O75530 1/20 0.52
RBBP4 Q09028 1/20 0.52
SUZ12 Q15022 1/20 0.52
RBBP7 Q16576 1/20 0.52
AEBP2 Q6ZN18 1/20 0.52
PARP1 P09874 1/20 0.52

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
SCHEMBL2592733 0.89 EZH2 (0.58) EZH2HDAC1HDAC6EEDSUZ12
SCHEMBL12180763 0.88 EZH2 (0.68) EZH2HDAC1HDAC6EZH1EED
SCHEMBL14816656 0.87 EZH2 (0.55) EZH2EEDRBBP4SUZ12RBBP7
SCHEMBL2588061 0.86 EZH2 (0.62) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL2592252 0.86 EZH2 (0.58) EZH2HDAC1HDAC6EZH1EED
SCHEMBL14716515 0.86 EZH2 (0.64) EZH2HDAC1HDAC6EZH1EED
SCHEMBL2594806 0.84 EZH2 (0.75) EZH2HDAC1HDAC6EZH1EED
SCHEMBL2588565 0.84 EZH2 (0.60) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL14733312 0.83 EZH2 (0.56) EZH2EZH1EEDRBBP4SUZ12
SCHEMBL2590359 0.82 EZH2 (0.78) EZH2HDAC1HDAC6EZH1EED

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9018382-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2015-04-28 US claimed
EP-2566328-B1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2015-03-04 EP claimed
US-20140350013-A1 INDAZOLES GLAXOSMITHKLINE LLC 2014-11-27 US claimed
US-20130053383-A1 INDAZOLES GLAXOSMITHKLINE LLC 2013-02-28 US claimed
US-9018382-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2015-04-28 US disclosed
US-9018382-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2015-04-28 US disclosed
US-9018382-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2015-04-28 US disclosed
EP-2566328-B1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2015-03-04 EP disclosed
EP-2566328-B1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2015-03-04 EP disclosed
US-20140350013-A1 INDAZOLES GLAXOSMITHKLINE LLC 2014-11-27 US disclosed
US-20140350013-A1 INDAZOLES GLAXOSMITHKLINE LLC 2014-11-27 US disclosed
US-20140350013-A1 INDAZOLES GLAXOSMITHKLINE LLC 2014-11-27 US disclosed
US-8846935-B2 Indazoles GLAXOSMITHKLINE LLC (US) 2014-09-30 US disclosed
WO-2013067300-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2013-05-10 WO disclosed
EP-2566328-A1 INDAZOLES GlaxoSmithKline LLC (US) 2013-03-13 EP disclosed
US-20130053383-A1 INDAZOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053383-A1 INDAZOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053383-A1 INDAZOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
WO-2011140325-A1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO disclosed
WO-2011140325-A1 INDAZOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 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 (2 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-20130053383-A1 INDAZOLES IDH3A, CYP3A7, IDH3B EZH2 1599/4885HDAC1 101/4885HDAC6 212/4885
US-20140350013-A1 INDAZOLES IDH3A, CYP3A7, IDH3B EZH2 1599/4885HDAC1 101/4885HDAC6 212/4885

“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.