SCHEMBL13999995

SCHEMBL13999995

c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-n5c(-c6ccccc6-c6ccccc6)nc6ccccc65)cc4)c4ccccc34)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 5/20 0.55
ESR1 P03372 4/20 0.55
RECQL P46063 1/20 0.51
RAB9A P51151 1/20 0.49
GRIA1 P42261 1/20 0.47
CACNG8 Q8WXS5 1/20 0.47
CACNG2 Q9Y698 1/20 0.47
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
HSP90AA1 P07900 1/20 0.45
MAPT P10636 1/20 0.45
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
KDM4E B2RXH2 1/20 0.43
PTGS2 P35354 1/20 0.43
PRKACA P17612 1/20 0.41
RPS6KB1 P23443 1/20 0.41
GSK3B P49841 1/20 0.41

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
SCHEMBL25769060 0.99 ESR2 (0.56) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL13999910 0.96 ESR2 (0.53) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL21392530 0.95 ESR1 (0.62) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL14000273 0.94 ESR2 (0.49) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL14363283 0.94 ESR1 (0.58) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL2604850 0.94 ESR1 (0.58) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL26343629 0.93 RECQL (0.53) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL2604830 0.92 ESR1 (0.59) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL14363290 0.91 ESR2 (0.49) ESR2ESR1RECQLRAB9AGRIA1
SCHEMBL25769028 0.91 ESR2 (0.51) ESR2ESR1RECQLRAB9AGRIA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230217821-A1 Light Emitting Device and Light Emitting Display Device Including the Same LG DISPLAY CO., LTD. (KR) 2023-07-06 US disclosed
US-20230217821-A1 Light Emitting Device and Light Emitting Display Device Including the Same LG DISPLAY CO., LTD. (KR) 2023-07-06 US disclosed
EP-4207995-A1 LIGHT EMITTING DEVICE AND LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG Display Co., Ltd. (KR) 2023-07-05 EP disclosed
EP-2000464-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME Idemitsu Kosan Co., Ltd. (JP) 2008-12-10 EP disclosed
US-20070267970-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-11-22 US disclosed
US-20070267970-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-11-22 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 (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-20230217821-A1 Light Emitting Device and Light Emitting Display Device Including the Same DBH, PRPH, NBAS ESR2 1051/4885ESR1 213/4885RECQL 3884/4885
US-20070267970-A1 NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVES AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME NUDC, NUDT1, SLC43A1 ESR2 2015/4885ESR1 1029/4885RECQL 1618/4885

“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.