SCHEMBL13636790

SCHEMBL13636790

CC1(C)OB(c2cccc(/C=C/c3ccc(N(c4ccc(/C=C/c5cccc(B6OC(C)(C)C(C)(C)O6)c5)cc4)c4ccc(/C=C/c5cccc(B6OC(C)(C)C(C)(C)O6)c5)cc4)cc3)c2)OC1(C)C

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 12/20 0.45
LPL P06858 11/20 0.45
P4HB P07237 1/20 0.42
APP P05067 1/20 0.40
RELA Q04206 2/20 0.37
NFE2L2 Q16236 3/20 0.33
IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL13636793 0.95 NFE2L2 (0.42) LIPGLPLP4HBAPPRELA
SCHEMBL13636792 0.94 LPL (0.44) LIPGLPLP4HBAPPRELA
SCHEMBL13636794 0.91 LIPG (0.39) LIPGLPLP4HBAPPRELA
SCHEMBL13636800 0.90 NFE2L2 (0.42) LIPGLPLP4HBAPPNFE2L2
SCHEMBL13855293 0.85 P4HB (0.51) LIPGLPLP4HBRELA
SCHEMBL13636787 0.85 P4HB (0.51) LIPGLPLP4HBRELA
SCHEMBL13979251 0.83 P4HB (0.36) LIPGLPLP4HB
SCHEMBL15372954 0.80 LIPG (0.47) LIPGLPLP4HBIRAK4
SCHEMBL12802855 0.80 P4HB (0.54) LIPGLPLP4HB
SCHEMBL12802856 0.80 P4HB (0.54) LIPGLPLP4HB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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 LIPG 1058/4885LPL 684/4885P4HB 1762/4885

“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.