SCHEMBL702795

SCHEMBL702795

O=Cc1ccccc1-c1c2ccccc2c(-c2ccccc2C=O)c2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 1/20 0.55
BLM P54132 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
ALDH1A1 P00352 4/20 0.44
TSHR P16473 1/20 0.44
TRIM24 O15164 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
CYP2A6 P11509 3/20 0.42
IMPDH2 P12268 2/20 0.42
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
XDH P47989 1/20 0.40
PTPN1 P18031 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL702491 0.86 CES1 (0.47) LMNAKMT2AMEN1THRBBLM
SCHEMBL249552 0.82 KMT2A (0.71) LMNAKMT2AMEN1THRBBLM
SCHEMBL31175932 0.82 KMT2A (0.71) LMNAKMT2AMEN1THRBBLM
SCHEMBL9914806 0.81 ERN1 (0.45) LMNAKMT2AMEN1THRBBLM
SCHEMBL31588841 0.79 KMT2A (0.67) LMNAKMT2AMEN1THRBBLM
SCHEMBL976750 0.79 LMNA (0.52) LMNAKMT2AMEN1THRBBLM
SCHEMBL28568883 0.79 TRIM24 (0.54) LMNAKMT2AMEN1THRBBLM
SCHEMBL1974950 0.77 LMNA (0.50) LMNAKMT2AMEN1THRBBLM
SCHEMBL31134296 0.77 ALDH1A1 (0.43) LMNAKMT2AMEN1THRBBLM
SCHEMBL548462 0.76 MEN1 (0.48) LMNAKMT2AMEN1THRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807481-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2018-06-20 EP disclosed
EP-1807481-B1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2018-06-20 EP disclosed
EP-1859005-B1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-04-27 EP disclosed
EP-1859005-B1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-04-27 EP disclosed
US-8940407-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2015-01-27 US disclosed
US-8940407-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2015-01-27 US disclosed
US-8940407-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2015-01-27 US disclosed
US-8124249-B2 Derivatives of fused aromatic systems; stability; sublimation stability; easy to purify due to better solubilty; easy reproducibility because do not form isomers MERCK PATENT GMBH (DE) 2012-02-28 US disclosed
US-8124249-B2 Derivatives of fused aromatic systems; stability; sublimation stability; easy to purify due to better solubilty; easy reproducibility because do not form isomers MERCK PATENT GMBH (DE) 2012-02-28 US disclosed
US-8124249-B2 Derivatives of fused aromatic systems; stability; sublimation stability; easy to purify due to better solubilty; easy reproducibility because do not form isomers MERCK PATENT GMBH (DE) 2012-02-28 US disclosed
US-20090072712-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2009-03-19 US disclosed
US-20090072712-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2009-03-19 US disclosed
US-20090072712-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2009-03-19 US disclosed
US-20080171225-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-07-17 US disclosed
US-20080171225-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-07-17 US disclosed
US-20080171225-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-07-17 US disclosed
EP-1859005-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2007-11-28 EP disclosed
EP-1807481-A1 ORGANIC ELECTROLUMINESCENT DEVICE Merck Patent GmbH (DE) 2007-07-18 EP disclosed
WO-2006097208-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2006-09-21 WO disclosed
WO-2006048268-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2006-05-11 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-20080171225-A1 Novel Materials For Organic Electroluminescent Devices OR10J3, EML4, TYR LMNA 3108/4885KMT2A 2174/4885MEN1 3497/4885
US-20090072712-A1 Organic Electroluminescent Device MAL2, ELAVL1, ELAVL3 LMNA 3781/4885KMT2A 1899/4885MEN1 2330/4885

“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.