SCHEMBL715966

SCHEMBL715966

O=Cc1c(Br)oc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
THRB P10828 1/20 0.51
MAOA P21397 3/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 1/20 0.43
CYP3A4 P08684 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
PGAM1 P18669 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TOP2A P11388 1/20 0.43
PADI4 Q9UM07 1/20 0.39
PTPN1 P18031 1/20 0.38
MAOB P27338 1/20 0.38
TNKS O95271 1/20 0.38
NQO1 P15559 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL31332447 1.00 KDM4E (0.51) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL5226658 0.78 KDM4E (0.53) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL15842324 0.76 KDM4E (0.56) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL1163384 0.76 KDM4E (0.51) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL2448418 0.76 KDM4E (0.51) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL1554147 0.73 DDR2 (0.57) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL25405004 0.72 MAOA (0.48) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL2016355 0.72 MAOA (0.48) KDM4ETHRBMAOAALDH1A1SMN1; SMN2
SCHEMBL11372717 0.72 KDM4E (0.47) KDM4ETHRBALDH1A1MAPTTOP2A
SCHEMBL719026 0.72 EYA3 (0.48) KDM4ETHRBMAOAALDH1A1SMN1; SMN2

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
EP-1871782-B1 DIPHOSPHINES AND METAL COMPLEXES UMICORE AG & CO KG (DE) 2012-02-29 EP disclosed
US-7863447-B2 Diphosphines and metal complexes UMICORE AG & CO., KG (DE) 2011-01-04 US disclosed
US-7837981-B2 Methods for imaging soluble A-beta GENERAL ELECTRIC COMPANY (US) 2010-11-23 US disclosed
EP-1631561-B1 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING OF SOLUBLE BETA-AMYLOID GEN ELECTRIC (US) 2010-08-18 EP disclosed
US-7727511-B2 Agents for imaging soluble a-beta GENERAL ELECTRIC COMPANY (US) 2010-06-01 US disclosed
US-20090270622-A1 Diphosphines and Metal Complexes UMICORE AG & CO., KG (DE) 2009-10-29 US disclosed
EP-1871782-A2 DIPHOSPHINES AND METAL COMPLEXES Umicore AG & Co. KG (DE) 2008-01-02 EP disclosed
US-20070189967-A1 AGENTS FOR IMAGING SOLUBLE A-BETA GENERAL ELECTRIC COMPANY (US) 2007-08-16 US disclosed
US-20070140960-A1 METHODS FOR IMAGING SOLUBLE A-BETA GENERAL ELECTRIC COMPANY (US) 2007-06-21 US disclosed
WO-2006111535-A2 DIPHOSPHINES AND METAL COMPLEXES UMICORE AG & CO. KG (DE) 2006-10-26 WO disclosed
EP-1631561-A2 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING OF SOLUBLE BETA-AMYLOID GENERAL ELECTRIC COMPANY (US) 2006-03-08 EP disclosed
WO-2004100998-A2 COMPOSITIONS AND METHODS FOR NON-INVASIVE IMAGING OF SOLUBLE BETA-AMYLOID GENERAL ELECTRIC COMPANY (US) 2004-11-25 WO disclosed
US-20040223909-A1 Compositions and methods for non-invasive imaging of soluble beta-amyloid GENERAL ELECTRIC COMPANY 2004-11-11 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 (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-20090270622-A1 Diphosphines and Metal Complexes C9, AP3S1, C5 KDM4E 3841/4885THRB 1103/4885MAOA 3519/4885
US-20040223909-A1 Compositions and methods for non-invasive imaging of soluble beta-amyloid APP, APBA1, BACE1 KDM4E 4841/4885THRB 2029/4885MAOA 1092/4885
US-20070140960-A1 METHODS FOR IMAGING SOLUBLE A-BETA APBA1, APP, FABP7 KDM4E 4759/4885THRB 1258/4885MAOA 1292/4885
US-20070189967-A1 AGENTS FOR IMAGING SOLUBLE A-BETA APBA1, APP, FABP7 KDM4E 4807/4885THRB 1331/4885MAOA 1638/4885

“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.