SCHEMBL14727079

SCHEMBL14727079

COC(=O)c1cc(-c2ccc(F)c(OC)c2)cc2c1c(C)cn2C(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 9/20 0.40
EZH1 Q92800 3/20 0.38
KMT2A Q03164 1/20 0.36
FFAR4 Q5NUL3 1/20 0.36
MAPT P10636 1/20 0.35
PIK3CD O00329 1/20 0.35
ABL1 P00519 1/20 0.35
EGFR P00533 1/20 0.35
HCK P08631 1/20 0.35
SRC P12931 1/20 0.35
KDR P35968 1/20 0.35
PIK3CA P42336 1/20 0.35
PIK3CB P42338 1/20 0.35
MTOR P42345 1/20 0.35
PIK3CG P48736 1/20 0.35
EPHB4 P54760 1/20 0.35
PRKDC P78527 1/20 0.35
PI4KB Q9UBF8 1/20 0.35
AVPR1B P47901 4/20 0.35
GRIN2B Q13224 1/20 0.34

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
SCHEMBL2594002 0.86 ERN1 (0.43) EZH2EZH1FFAR4MAPTNR4A2
SCHEMBL14917583 0.82 EZH2 (0.42) EZH2EZH1KMT2AFFAR4MAPT
SCHEMBL19620967 0.80 EZH2 (0.67) EZH2EZH1EEDSUZ12
SCHEMBL2588982 0.77 EZH2 (0.40) EZH2EZH1NR4A2EEDSUZ12
SCHEMBL2587259 0.76 CA12 (0.37) EZH2KMT2AMAPTABL1
SCHEMBL2587361 0.74 CA12 (0.35) EZH2KMT2AMAPTNR4A2
SCHEMBL2595218 0.73 EZH2 (0.61) EZH2EZH1EEDSUZ12
SCHEMBL17970480 0.72 EZH2 (0.44) EZH2EZH1FFAR4EEDSUZ12
SCHEMBL12180129 0.72 EZH2 (0.41) EZH2EZH1FFAR4GRIN2BEED
SCHEMBL2592122 0.72 CA12 (0.36) EZH2EZH1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-20150313887-A1 INDOLES GLAXOSMITHKLINE LLC 2015-11-05 US disclosed
US-9114141-B2 Indoles GLAXOSMITHKLINE LLC (US) 2015-08-25 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
US-8536179-B2 Indoles GLAXOSMITHKLINE LLC (US) 2013-09-17 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 (6 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 EZH2 2/4885EZH1 1/4885KMT2A 50/4885
US-20150141436-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885EZH1 669/4885KMT2A 1008/4885
US-20140256739-A1 METHOD OF TREATMENT EZH1, EZH2, SUV39H2 EZH2 2/4885EZH1 1/4885KMT2A 50/4885
US-20150313887-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885EZH1 669/4885KMT2A 1008/4885
US-20130053397-A1 INDOLES IDO1, IDO2, INMT EZH2 239/4885EZH1 677/4885KMT2A 933/4885
US-20160296518-A1 INDOLES IDO1, IDO2, INMT EZH2 257/4885EZH1 669/4885KMT2A 1008/4885

“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.