SCHEMBL1689466

SCHEMBL1689466

Brc1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1.c1ccc(-c2cccc3cc4ccccc4cc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.44
ESR2 Q92731 4/20 0.44
ALDH1A1 P00352 2/20 0.41
MAPK1 P28482 2/20 0.41
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 1/20 0.39
MPI P34949 1/20 0.39
GRM2 Q14416 1/20 0.39
ALOX5 P09917 1/20 0.38
GPR84 Q9NQS5 2/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
TNF P01375 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL27910724 0.92 ALOX5 (0.42) ESR1ESR2ALDH1A1MAPK1KDM4E
SCHEMBL27703335 0.92 ALOX5 (0.42) ESR1ESR2ALDH1A1MAPK1KDM4E
SCHEMBL28606956 0.92 ESR1 (0.50) ESR1ESR2ALDH1A1KDM4EMAPT
SCHEMBL27610205 0.91 ESR1 (0.51) ESR1ESR2ALDH1A1MAPK1KDM4E
SCHEMBL27831504 0.89 CYP2A6 (0.43) ALDH1A1MAPK1KDM4EHPGDGRM2
SCHEMBL27717449 0.87 CYP2A6 (0.42) ALDH1A1MAPK1KDM4EHPGDGRM2
SCHEMBL1816243 0.84 ESR1 (0.46) ESR1ESR2ALDH1A1KDM4EMAPT
SCHEMBL28608324 0.84 ESR1 (0.46) ESR1ESR2ALDH1A1KDM4EMAPT
SCHEMBL18980974 0.84 ESR1 (0.45) ESR1ESR2ALDH1A1MAPK1KDM4E
SCHEMBL28491556 0.84 HDAC8 (0.50) ALDH1A1MAPK1CA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2479814-B1 Light emitting device comprising a carbazole-anthracene derivative SEMICONDUCTOR ENERGY LAB (JP) 2015-07-22 EP disclosed
EP-1896413-B1 ANTHRACENE DERIVATIVE, MATERIAL FOR LIGHT EMITTING ELEMENT, LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2015-04-22 EP disclosed
US-8603647-B2 Anthracene derivative, material for light emitting element, light emitting element, light emitting device, and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-12-10 US disclosed
US-20130005067-A1 Anthracene Derivative, Material For Light Emitting Element, Light Emitting Element, Light Emitting Device, And Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2013-01-03 US disclosed
US-8298687-B2 Anthracene derivative, material for light emitting element, light emitting element, light emitting device, and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-10-30 US disclosed
EP-2479814-A1 Light emitting device comprising a carbazole-anthracene derivative Semiconductor Energy Laboratory Co, Ltd. (JP) 2012-07-25 EP disclosed
US-20120007066-A1 ANTHRACENE DERIVATIVE, MATERIAL FOR LIGHT EMITTING ELEMENT, LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-01-12 US disclosed
US-8039122-B2 Anthracene derivative, material for light emitting element, light emitting element, light emitting device, and electronic device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2011-10-18 US disclosed
US-20090015140-A1 Anthracene Derivative, Material for Light Emitting Element, Light Emitting Element, Light Emitting Device, and Electronic Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-01-15 US disclosed
EP-1896413-A1 ANTHRACENE DERIVATIVE, MATERIAL FOR LIGHT EMITTING ELEMENT, LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2008-03-12 EP disclosed
WO-2006104221-A1 ANTHRACENE DERIVATIVE, MATERIAL FOR LIGHT EMITTING ELEMENT, LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2006-10-05 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-20090015140-A1 Anthracene Derivative, Material for Light Emitting Element, Light Emitting Element, Light Emitting Device, and Electronic Device CRY1, CRY2, CYBA ESR1 166/4885ESR2 352/4885ALDH1A1 61/4885

“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.