SCHEMBL2593367

SCHEMBL2593367

Cc1cc(C)c(CNC(=O)c2cc(-c3cccnc3)cc3c2ccn3C(C)C)c(=O)[nH]1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 20/20 0.68
BRD4 O60885 4/20 0.61
EED O75530 3/20 0.56
SUZ12 Q15022 3/20 0.56
EZH1 Q92800 3/20 0.54
RBBP4 Q09028 2/20 0.54
RBBP7 Q16576 2/20 0.54
AEBP2 Q6ZN18 1/20 0.54
BRD2 P25440 1/20 0.54
BRD3 Q15059 1/20 0.54
BRDT Q58F21 1/20 0.54

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
SCHEMBL2592665 0.90 EZH2 (0.67) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL2594609 0.90 EZH2 (0.75) EZH2BRD4EZH1BRD2BRD3
SCHEMBL12180143 0.89 EZH2 (0.54) EZH2BRD4EEDSUZ12EZH1
SCHEMBL14716510 0.88 EZH2 (0.72) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL12180112 0.88 EZH2 (0.69) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL2594546 0.85 EZH2 (0.60) EZH2BRD4EEDSUZ12EZH1
SCHEMBL2588061 0.84 EZH2 (0.62) EZH2EEDSUZ12EZH1RBBP4
SCHEMBL18863744 0.83 EZH2 (0.78) EZH2BRD4EEDSUZ12EZH1
SCHEMBL14726796 0.82 EZH2 (0.66) EZH2BRD4EZH1BRD2BRD3
SCHEMBL2595229 0.82 EZH2 (0.66) EZH2BRD4EZH1BRD2BRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 EP claimed
EP-2773754-B1 Compounds for use in the treatment of T-cell mediated diseases GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-08-03 EP claimed
US-9402836-B2 Indoles GLAXOSMITHKLINE LLC (US) 2016-08-02 US claimed
US-20150313887-A1 INDOLES GLAXOSMITHKLINE LLC 2015-11-05 US claimed
US-8975291-B2 Indoles GLAXOSMITHKLINE LLC (US) 2015-03-10 US claimed
US-20130345200-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2013-12-26 US claimed
EP-2566327-A1 INDOLES GlaxoSmithKline LLC (US) 2013-03-13 EP claimed
WO-2011140324-A1 INDOLES GLAXOSMITHKLINE LLC (US) 2011-11-10 WO claimed
EP-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 EP disclosed
EP-3246027-A1 INDOLE DERIVATIVES FOR THE TREATMENT OF CANCER GlaxoSmithKline LLC (US) 2017-11-22 EP disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-20160296518-A1 INDOLES GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
US-8536179-B2 Indoles GLAXOSMITHKLINE LLC (US) 2013-09-17 US disclosed
WO-2013067296-A1 METHOD OF TREATMENT GLAXOSMITHKLINE INTELLECTUAL PROPERTY (No 2) LIMITED (GB) 2013-05-10 WO disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
US-20130053397-A1 INDOLES GLAXOSMITHKLINE LLC 2013-02-28 US disclosed
WO-2011140324-A1 INDOLES 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 (4 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-20150313887-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885BRD4 190/4885EED 3322/4885
US-20130345200-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885BRD4 190/4885EED 3322/4885
US-20130053397-A1 INDOLES IDO1, IDO2, INMT EZH2 239/4885BRD4 177/4885EED 3258/4885
US-20160296518-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885BRD4 190/4885EED 3322/4885

“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.