SCHEMBL423136

SCHEMBL423136

C=Cc1c(-c2ccc3cc4ccccc4cc3c2-c2ccc(-c3ccccc3)c(-c3ccccc3)c2C=C)ccc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.35
ESR2 Q92731 5/20 0.35
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
MPI P34949 1/20 0.33
GPR84 Q9NQS5 3/20 0.32
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
HSD17B1 P14061 1/20 0.31
CYP2B6 P20813 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B2 P37059 1/20 0.31
PTGS2 P35354 1/20 0.31
ALOX5 P09917 2/20 0.31

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
SCHEMBL28817754 0.81 MEN1 (0.40) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL30661015 0.80 ESR1 (0.46) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL32080 0.80 ESR1 (0.46) ESR1ESR2MEN1KMT2AKDM4E
Benzene SCHEMBL27418790 0.80 ESR1 (0.46) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL31254074 0.80 ESR1 (0.46) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL423135 0.79 ESR1 (0.39) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL3202035 0.78 ESR1 (0.44) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL28463046 0.78 ESR1 (0.44) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL49889 0.78 ESR1 (0.44) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL30484243 0.78 ESR1 (0.44) ESR1ESR2MEN1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023224400-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 경상국립대학교산학협력단 2023-11-23 WO disclosed
WO-2022203403-A1 NOVEL HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 경상국립대학교산학협력단 2022-09-29 WO disclosed
WO-2021141370-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DIODE COMPRISING SAME 경상국립대학교산학협력단 2021-07-15 WO disclosed
US-10991890-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same DUK SAN NEOLUX CO., LTD. (KR) 2021-04-27 US disclosed
US-20180315931-A1 COMPOUND CONTAINING A 5-MEMBERED HETEROCYCLE AND ORGANIC LIGHT-EMITTING DIODE USING SAME, AND TERMINAL FOR SAME DUK SAN NEOLUX CO., LTD. (KR) 2018-11-01 US disclosed
US-10020452-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2018-07-10 US disclosed
US-9691990-B2 Compound, organic electronic element using same, and electronic device using the latter DUK SAN NEOLUX CO., LTD. (KR) 2017-06-27 US disclosed
US-9496520-B2 Organic electronic element including light efficiency improving layer, electronic device including the same, and compound for the same DUK SAN NEOLUX CO., LTD. (KR) 2016-11-15 US disclosed
US-9290513-B2 Compound containing 5-membered heterocycles, organic electronic device using same, and terminal comprising the latter DUK SAN NEOLUX CO., LTD. (KR) 2016-03-22 US disclosed
EP-2415773-B1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUK SAN NEOLUX CO LTD (KR) 2016-02-17 EP disclosed
EP-2415773-A2 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL Duksan Hi-Metal Co., Ltd. (KR) 2012-02-08 EP disclosed
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUKSAN HIGH METAL CO., LTD. (KR) 2012-01-26 US disclosed
EP-1725632-A4 NEW MATERIALS FOR INJECTING OR TRANSPORTING HOLES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME LG CHEMICAL LTD (KR) 2009-05-06 EP disclosed
EP-1725632-A1 NEW MATERIALS FOR INJECTING OR TRANSPORTING HOLES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME LG Chem, Ltd. (KR) 2006-11-29 EP disclosed
US-20050225235-A1 Materials for injecting or transporting holes and organic electroluminescence devices using the same LG CHEM, LTD. (KR) 2005-10-13 US disclosed
WO-2005090512-A1 NEW MATERIALS FOR INJECTING OR TRANSPORTING HOLES AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME LG CHEM, LTD. (KR) 2005-09-29 WO disclosed
US-6878469-B2 Material for transporting electrons and organic electroluminescent display using the same LG CHEM, LTD. (KR) 2005-04-12 US disclosed
EP-1465874-A2 NEW MATERIAL FOR TRANSPORTING ELECTRONS AND ORGANIC ELECTROLUMINESCENT DISPLAY USING THE SAME LG Chem, Ltd. (KR) 2004-10-13 EP disclosed
US-20030165715-A1 New material for transporting electrons and organic electroluminescent display using the same LG CHEM, LTD. (KR) 2003-09-04 US disclosed
WO-2003060956-A2 NEW MATERIAL FOR TRANSPORTING ELECTRONS AND ORGANIC ELECTROLUMINESCENT DISPLAY USING THE SAME LG CHEM, LTD. (KR) 2003-07-24 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 (5 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-10991890-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same NOTUM, OR10J3, PER2 ESR1 127/4885ESR2 896/4885MEN1 1767/4885
US-10020452-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same NOTUM, OR10J3, PER2 ESR1 127/4885ESR2 896/4885MEN1 1767/4885
US-20030165715-A1 New material for transporting electrons and organic electroluminescent display using the same TIMM10, TMED9, SLCO4C1 ESR1 254/4885ESR2 1018/4885MEN1 2109/4885
US-20050225235-A1 Materials for injecting or transporting holes and organic electroluminescence devices using the same SLCO4C1, SLC18A3, SLCO2A1 ESR1 1240/4885ESR2 2048/4885MEN1 2754/4885
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL OR10J3, OR51E2, ESR1 ESR1 3/4885ESR2 48/4885MEN1 1434/4885

“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.