SCHEMBL13636764

SCHEMBL13636764

FC1(c2ccc(/C=C/c3ccc(N(c4ccc(/C=C/c5ccc(C6(F)CCCCC6)cc5)cc4)c4ccc(/C=C/c5ccc(C6(F)CCCCC6)cc5)cc4)cc3)cc2)CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.34
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MAPT P10636 2/20 0.32
CASP1 P29466 2/20 0.32
HBB P68871 2/20 0.32
GAA P10253 1/20 0.32
BRCA1 P38398 1/20 0.32
CASP7 P55210 1/20 0.32
RELA Q04206 1/20 0.32
MAT2A P31153 1/20 0.30
KCNH2 Q12809 1/20 0.30
HPGD P15428 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL13636761 0.79 RELA (0.35) APPMEN1KMT2AALDH1A1LMNA
SCHEMBL3309457 0.76 ESR1 (0.41) APPMEN1KMT2AALDH1A1GAA
SCHEMBL13386141 0.69 ALDH1A1 (0.44) MEN1KMT2AALDH1A1LMNARECQL
SCHEMBL2510806 0.68 TRIM24 (0.39) MEN1KMT2AALDH1A1MAPTGAA
SCHEMBL13636772 0.68 ALDH1A1 (0.33) APPALDH1A1LMNAGAARELA
SCHEMBL23415061 0.67 HDAC1 (0.36) ALDH1A1SLC6A3
SCHEMBL415543 0.66 SLC6A4 (0.47) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL13636755 0.66 APP (0.68) APP
SCHEMBL13636765 0.66 LMNA (0.50) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL13636754 0.64 KMT2A (0.40) MEN1KMT2AALDH1A1LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1957605-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-01-11 EP disclosed
EP-1957603-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-10-14 EP disclosed
US-8785001-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 US disclosed
US-8785001-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2014-07-22 US disclosed
US-8304095-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-8304095-B2 Organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-11-06 US disclosed
US-20080297037-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-04 US disclosed
US-20080297037-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-04 US disclosed
US-20080272693-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-11-06 US disclosed
US-20080272693-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-11-06 US disclosed
WO-2007065549-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-06-14 WO disclosed
WO-2007065547-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2007-06-14 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 (1 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-20080272693-A1 Organic Electroluminescent Devices EML4, MT-ND4L, EPCAM APP 2549/4885MEN1 3327/4885KMT2A 1866/4885

“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.