SCHEMBL80903

SCHEMBL80903

[c]1ccc2c3ccccc3nn2n1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.33
GPR3 P46089 1/20 0.32
MPO P05164 5/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TSHR P16473 2/20 0.30
HSD17B10 Q99714 2/20 0.30
ESR2 Q92731 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL17417258 0.73 KDM4E (0.33) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL79404 0.69 PTGS2 (0.36) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL12612219 0.69 KDM4E (0.33) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL6837854 0.68 KDM4E (0.34) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL588442 0.67 KDM4E (0.37) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL534928 0.67 KDM4E (0.33) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL69767 0.64 KDM4E (0.34) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL1521620 0.63 ALDH1A1 (0.33) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL588416 0.62 KDM4E (0.36) KDM4EGPR3MPOALDH1A1MAPT
SCHEMBL4162489 0.61 KDM4E (0.35) KDM4EGPR3MPOALDH1A1MAPT

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 1148 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12004417-B2 Heterocyclic compound and light-emitting device including same SAMSUNG DISPLAY CO., LTD. (KR) 2024-06-04 US claimed
CN-117924246-A Pi conjugated compound, organic electroluminescent element material, luminescent thin film, organic electroluminescent element, display device, and lighting device 默克专利有限公司 2024-04-26 CN claimed
US-11944008-B2 Heterocyclic compound and light-emitting device including same SAMSUNG DISPLAY CO., LTD. (KR) 2024-03-26 US claimed
US-11925106-B2 Condensed cyclic compound, composition including the same, and organic light-emitting device including the condensed cyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-03-05 US claimed
US-20240074310-A1 LIGHT-EMITTING DEVICE, AND DISPLAY APPARATUS AND ELECTRONIC APPARATUS INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2024-02-29 US claimed
CN-117596910-A Light emitting device, display apparatus including the same, and electronic apparatus 三星显示有限公司 2024-02-23 CN claimed
CN-117024330-A Heterocyclic compound, composition comprising same, and organic light-emitting device comprising same 三星电子株式会社 2023-11-10 CN claimed
WO-2023171688-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-14 WO claimed
US-11706977-B2 Heterocyclic compound, composition including the same, and organic light-emitting device including the heterocyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-18 US claimed
US-11690287-B2 Organic light-emitting device and display apparatus including the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-06-27 US claimed
US-20160013419-A1 AMINE COMPOUND HAVING HETERO-FUSED RING AND ORGANIC ELECTROLUMINESCENT ELEMENT USING AMINE COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2016-01-14 US claimed
EP-2917950-A1 PHENOXASILINE BASED COMPOUNDS FOR ELECTRONIC APPLICATION BASF SE (DE) 2015-09-16 EP claimed
US-9067919-B2 Use of dibenzofurans and dibenzothiophenes substituted by nitrogen-bonded five-membered heterocyclic rings in organic electronics BASF SE (DE) 2015-06-30 US claimed
US-8778507-B2 Organic electroluminescent device, display and illuminating device KONICA MINOLTA HOLDINGS, INC. (JP) 2014-07-15 US claimed
WO-2014072320-A1 PHENOXASILINE BASED COMPOUNDS FOR ELECTRONIC APPLICATION BASF SE (DE) 2014-05-15 WO claimed
EP-2590967-A2 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS BASF SE (DE) 2013-05-15 EP claimed
US-20120012821-A1 SILYL- AND HETEROATOM-SUBSTITUTED COMPOUNDS SELECTED FROM CARBAZOLES, DIBENZOFURANS, DIBENZOTHIOPHENES AND DIBENZOPHOSPHOLES, AND USE THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2012-01-19 US claimed
WO-2012004765-A2 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS BASF SE (DE) 2012-01-12 WO claimed
US-20120007063-A1 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS BASF SE (DE) 2012-01-12 US claimed
WO-2010079051-A1 SILYL AND HETEROATOM SUBSTITUTED COMPOUNDS SELECTED FROM CARBAZOLES, DIBENZOFURANS, DIBENZOTHIOPHENES AND DIBENZO PHOSPHOLES AND THE APPLICATION THEREOF IN ORGANIC ELECTRONICS BASF SE (DE) 2010-07-15 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 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-12004417-B2 Heterocyclic compound and light-emitting device including same CRY1, CYP1A1, CYP2E1 KDM4E 3171/4885GPR3 2791/4885MPO 478/4885
US-11706977-B2 Heterocyclic compound, composition including the same, and organic light-emitting device including the heterocyclic compound CRY1, CYP1B1, CYP1A1 KDM4E 2739/4885GPR3 2168/4885MPO 758/4885
US-20160013419-A1 AMINE COMPOUND HAVING HETERO-FUSED RING AND ORGANIC ELECTROLUMINESCENT ELEMENT USING AMINE COMPOUND CTCF, SAT1, TEAD2 KDM4E 942/4885GPR3 3070/4885MPO 1255/4885
US-11925106-B2 Condensed cyclic compound, composition including the same, and organic light-emitting device including the condensed cyclic compound CCNB1, CCNA1, CCNT1 KDM4E 4280/4885GPR3 2086/4885MPO 3204/4885
US-11690287-B2 Organic light-emitting device and display apparatus including the same OR10J3, ALDH1A2, OCIAD1 KDM4E 3054/4885GPR3 1406/4885MPO 343/4885
US-20120007063-A1 USE OF DIBENZOFURANS AND DIBENZOTHIOPHENES SUBSTITUTED BY NITROGEN-BONDED FIVE-MEMBERED HETEROCYCLIC RINGS IN ORGANIC ELECTRONICS DDT, DBF4, POU5F1 KDM4E 1835/4885GPR3 3124/4885MPO 2162/4885
US-20120012821-A1 SILYL- AND HETEROATOM-SUBSTITUTED COMPOUNDS SELECTED FROM CARBAZOLES, DIBENZOFURANS, DIBENZOTHIOPHENES AND DIBENZOPHOSPHOLES, AND USE THEREOF IN ORGANIC ELECTRONICS DDT, CDKL1, CDK2 KDM4E 2857/4885GPR3 1523/4885MPO 2523/4885

“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.