SCHEMBL65344

SCHEMBL65344

c1ccc(-c2nc3ccccc3n2-c2nc(-n3c(-c4ccccc4)nc4ccccc43)nc(-n3c(-c4ccccc4)nc4ccccc43)n2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.63
ESR2 Q92731 1/20 0.63
MAPK1 P28482 1/20 0.55
HTT P42858 1/20 0.55
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 2/20 0.53
PDE6D O43924 1/20 0.53
ALDH2 P05091 1/20 0.53
ALDH3A1 P30838 1/20 0.53
HSD17B10 Q99714 3/20 0.50
GRIA1 P42261 1/20 0.49
CACNG8 Q8WXS5 1/20 0.49
CACNG2 Q9Y698 1/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 2/20 0.49
NPC1 O15118 1/20 0.49
TSHR P16473 2/20 0.47

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
SCHEMBL16687529 0.93 MAPK1 (0.62) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL15746080 0.91 ESR1 (0.58) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL22461713 0.86 ESR1 (0.65) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL541157 0.85 ESR2 (0.78) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL27418359 0.84 ESR1 (0.48) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL30282233 0.83 ESR2 (0.76) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL28338917 0.83 ESR2 (0.76) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL27860194 0.83 ESR2 (0.76) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL29406589 0.83 ESR2 (0.76) ESR1ESR2MAPK1HTTKDM4E
SCHEMBL13826483 0.81 ESR1 (0.59) ESR1ESR2MAPK1HTTKDM4E

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 174 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10868260-B2 Organic compound and photoelectric conversion element CANON KABUSHIKI KAISHA (JP) 2020-12-15 US disclosed
US-10411212-B2 Organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2019-09-10 US disclosed
US-10361387-B2 Light emitting layer-forming solid material, organic electroluminescent device and method for producing the same UDC IRELAND LIMITED (IE) 2019-07-23 US disclosed
US-20190119258-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT CANON KABUSHIKI KAISHA (JP) 2019-04-25 US disclosed
US-20190088885-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT CANON KABUSHIKI KAISHA (JP) 2019-03-21 US disclosed
US-9860960-B2 Organic EL display device and method for production of the same JOLED INC. (JP) 2018-01-02 US disclosed
US-20170271607-A1 DISPLAY DEVICE, DISPLAY UNIT, AND ELECTRONIC APPARATUS JOLED INC (JP) 2017-09-21 US disclosed
US-20170271607-A1 DISPLAY DEVICE, DISPLAY UNIT, AND ELECTRONIC APPARATUS JOLED INC (JP) 2017-09-21 US disclosed
US-20160072089-A1 Light Emitting Layer-Forming Solid Material, Organic Electroluminescent Device And Method For Producing The Same UDC IRELAND LTD (IE) 2016-03-10 US disclosed
US-20160072089-A1 Light Emitting Layer-Forming Solid Material, Organic Electroluminescent Device And Method For Producing The Same UDC IRELAND LTD (IE) 2016-03-10 US disclosed
US-20070172700-A1 having high light emitting efficiency and high driving durability; aluminum salt of 8-hydroxyquinoline FUJIFILM CORPORATION 2007-07-26 US disclosed
US-20070132373-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-06-14 US disclosed
US-20070132373-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-06-14 US disclosed
US-20070114919-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-05-24 US disclosed
US-20070114919-A1 Organic electroluminescence device FUJIFILM CORPORATION 2007-05-24 US disclosed
US-20070090756-A1 Organic electroluminescent element FUJIFILM CORPORATION (JP) 2007-04-26 US disclosed
US-20070090756-A1 Organic electroluminescent element FUJIFILM CORPORATION (JP) 2007-04-26 US disclosed
US-20070063156-A1 Organic photoelectric conversion element and image element FUJI PHOTO FILM CO., LTD. 2007-03-22 US disclosed
US-20070057630-A1 Organic electroluminescent element FUJI PHOTO FILM CO., LTD. 2007-03-15 US disclosed
US-20070057630-A1 Organic electroluminescent element FUJI PHOTO FILM CO., LTD. 2007-03-15 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 (3 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-10868260-B2 Organic compound and photoelectric conversion element CRY1, CYP1A1, CCNE2 ESR1 99/4885ESR2 501/4885MAPK1 615/4885
US-10411212-B2 Organic electroluminescent element L1CAM, NES, EML4 ESR1 10/4885ESR2 27/4885MAPK1 1256/4885
US-20190119258-A1 ORGANIC COMPOUND AND PHOTOELECTRIC CONVERSION ELEMENT SCN2B, MRPS22, CTNNA1 ESR1 243/4885ESR2 186/4885MAPK1 1329/4885

“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.