SCHEMBL2585411

SCHEMBL2585411

COCc1cc(C)[nH]c(=O)c1CNC(=O)c1cc(-c2ccc(N3CCN(C)CC3)nc2)cc2c1ccn2C(C)C

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EZH1 Q92800 13/20 0.68
EZH2 Q15910 12/20 0.68
EED O75530 5/20 0.68
SUZ12 Q15022 5/20 0.68
RBBP4 Q09028 4/20 0.68
AEBP2 Q6ZN18 4/20 0.68
RBBP7 Q16576 3/20 0.68
PRMT3 O60678 2/20 0.68
SETD7 Q8WTS6 2/20 0.68
ADRA1B P35368 1/20 0.57

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
SCHEMBL2594105 0.93 EZH2 (0.65) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL2595084 0.93 EZH1 (0.73) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL2595147 0.91 EZH1 (0.67) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL2592678 0.91 EZH2 (0.81) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL2593962 0.91 EZH2 (0.80) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL16115389 0.90 EZH1 (0.72) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL2592949 0.88 EZH1 (0.68) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL14917582 0.86 EZH2 (0.65) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL30956686 0.85 EZH2 (0.81) EZH1EZH2EEDSUZ12RBBP4
SCHEMBL20992055 0.85 EZH2 (0.81) EZH1EZH2EEDSUZ12RBBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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
US-9649307-B2 Indoles GLAXOSMITHKLINE LLC (US) 2017-05-16 US disclosed
US-20160296518-A1 INDOLES GLAXOSMITHKLINE LLC 2016-10-13 US disclosed
US-9446041-B2 Method of treatment GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2016-09-20 US disclosed
US-9402836-B2 Indoles GLAXOSMITHKLINE LLC (US) 2016-08-02 US disclosed
US-9402836-B2 Indoles GLAXOSMITHKLINE LLC (US) 2016-08-02 US disclosed
US-20160074394-A1 METHOD OF TREATMENT GLAXOSMITHKLINE LLC 2016-03-17 US disclosed
US-9242962-B2 Method of treatment GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO. 2) LIMITED (GB) 2016-01-26 US disclosed
US-20150141436-A1 INDOLES KIDS2, INC. 2015-05-21 US disclosed
US-8975291-B2 Indoles GLAXOSMITHKLINE LLC (US) 2015-03-10 US disclosed
US-20140256739-A1 METHOD OF TREATMENT GLAXOSMITHKLINE LLC 2014-09-11 US disclosed
EP-2773754-A1 METHOD OF TREATMENT Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2014-09-10 EP disclosed
US-8536179-B2 Indoles GLAXOSMITHKLINE LLC (US) 2013-09-17 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20160074394-A1 METHOD OF TREATMENT EZH1, EZH2, SUV39H2 EZH1 1/4885EZH2 2/4885EED 15/4885
US-20150141436-A1 INDOLES IDO1, IDO2, INMT EZH1 669/4885EZH2 257/4885EED 3322/4885
US-20140256739-A1 METHOD OF TREATMENT EZH1, EZH2, SUV39H2 EZH1 1/4885EZH2 2/4885EED 15/4885
US-20130053397-A1 INDOLES IDO1, IDO2, INMT EZH1 677/4885EZH2 239/4885EED 3258/4885
US-20160296518-A1 INDOLES IDO1, IDO2, INMT EZH1 669/4885EZH2 257/4885EED 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.