SCHEMBL3885909

SCHEMBL3885909

CC(C)(C)c1ccc2c(c1)C1(c3ccccc3-c3ccc(Br)cc31)c1cc(C(C)(C)C)ccc1-2

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.49
ALDH1A1 P00352 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
PLA2G1B P04054 1/20 0.44
NFKB1 P19838 1/20 0.44
CASP3 P42574 1/20 0.44
RAB9A P51151 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
PTPRC P08575 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MAPT P10636 3/20 0.34

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
SCHEMBL29456661 1.00 PDK2 (0.49) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL22744936 1.00 PDK2 (0.49) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL22745012 0.92 PDK2 (0.40) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL679067 0.92 PDK2 (0.40) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL23485172 0.92 PDK2 (0.43) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL23485173 0.92 PDK2 (0.43) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL29501082 0.92 PDK2 (0.43) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL21215242 0.90 ALDH1A1 (0.52) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL19934339 0.90 ALDH1A1 (0.52) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B
SCHEMBL30421958 0.90 ALDH1A1 (0.52) PDK2ALDH1A1L3MBTL1NPC1PLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250234771-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2025-07-17 US disclosed
US-20240244961-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2024-07-18 US disclosed
US-20240244961-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2024-07-18 US disclosed
US-20240023428-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2024-01-18 US disclosed
US-20240023428-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2024-01-18 US disclosed
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230348400-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING APPARATUS SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-11-02 US disclosed
WO-2023210698-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-11-02 WO disclosed
US-20230348400-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING APPARATUS SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-11-02 US disclosed
US-20130207046-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-08-15 US disclosed
US-20130207046-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-08-15 US disclosed
US-20090123720-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-05-14 US disclosed
US-20090123720-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-05-14 US disclosed
US-20090123720-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2009-05-14 US disclosed
EP-1858906-A4 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES AGENCY SCIENCE TECH & RES (SG) 2009-04-15 EP disclosed
EP-1858906-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES Agency for Science, Technology and Research (SG) 2007-11-28 EP disclosed
US-7247761-B2 Method for the production of aryl-aryl coupled compounds MERCK PATENT GMBH (DE) 2007-07-24 US disclosed
US-7247761-B2 Method for the production of aryl-aryl coupled compounds MERCK PATENT GMBH (DE) 2007-07-24 US disclosed
WO-2006093466-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2006-09-08 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-20230373941-A1 COMPOUNDS FOR ELECTRONIC DEVICES CYP2E1, GPX1, ERCC1 PDK2 461/4885ALDH1A1 115/4885L3MBTL1 3395/4885
US-20240023428-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE L1CAM, EPCAM, SELE PDK2 1268/4885ALDH1A1 561/4885L3MBTL1 1321/4885
US-20090123720-A1 SOLUTION PROCESSED ORGANOMETALLIC COMPLEXES AND THEIR USE IN ELECTROLUMINESCENT DEVICES BMI1, PCNA, DNMT1 PDK2 385/4885ALDH1A1 1068/4885L3MBTL1 1980/4885
US-20240244961-A1 ORGANIC COMPOUND, ELECTRONIC ELEMENT AND ELECTRONIC APPARATUS AOX1, AOC2, OSTC PDK2 1733/4885ALDH1A1 643/4885L3MBTL1 3297/4885
US-20230348400-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND LIGHT-EMITTING APPARATUS CCNL2, TBL2, TBL3 PDK2 1652/4885ALDH1A1 481/4885L3MBTL1 28/4885

“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.