SCHEMBL446563

SCHEMBL446563

Brc1c2ccccc2c(-c2c3ccccc3c(Br)c3ccccc23)c2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
ALDH1A1 P00352 6/20 0.37
TDP1 Q9NUW8 3/20 0.37
KDM4E B2RXH2 4/20 0.37
MAPK1 P28482 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
MAPT P10636 1/20 0.37
CYP2A6 P11509 2/20 0.35
HSD17B10 Q99714 2/20 0.35
TSHR P16473 1/20 0.35
GAA P10253 1/20 0.35
PTPN1 P18031 1/20 0.34
CYP1A2 P05177 4/20 0.33
CYP2C19 P33261 2/20 0.33
IDO1 P14902 1/20 0.33
CYP3A4 P08684 1/20 0.32
HPGD P15428 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GPR3 P46089 3/20 0.32

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
SCHEMBL7240160 1.00 POLB (0.39) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL28511 0.89 ALDH1A1 (0.44) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL29352635 0.89 ALDH1A1 (0.44) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL2185513 0.87 MAPK1 (0.48) ALDH1A1TDP1KDM4EMAPK1L3MBTL1
SCHEMBL7915432 0.86 POLB (0.42) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL4264420 0.85 POLB (0.34) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL3000291 0.85 KDM4E (0.42) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL701595 0.85 ALDH1A1 (0.35) POLBALDH1A1TDP1KDM4EMAPK1
SCHEMBL23119597 0.84 POLB (0.40) POLBALDH1A1TDP1KDM4EL3MBTL1
SCHEMBL2183920 0.84 ALOX5 (0.44) POLBALDH1A1TDP1KDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114914428-B High-first-effect hard carbon negative electrode material, preparation method thereof and sodium ion battery 大连中比动力电池有限公司 2023-07-28 CN claimed
CN-114057187-B Method for synthesizing one-dimensional graphene by needle tip induction 广东墨睿科技有限公司 2023-04-11 CN claimed
CN-115231987-A Method for synthesizing bay brominated bisantene 内蒙古大学 2022-10-25 CN claimed
CN-114914428-A High-first-efficiency hard carbon negative electrode material, preparation method thereof and sodium ion battery 大连中比动力电池有限公司 2022-08-16 CN claimed
CN-111180691-B Double-layer carbon-coated silicon-based composite material and preparation method and application thereof 安普瑞斯(南京)有限公司 2022-03-29 CN claimed
CN-114057187-A Method for synthesizing one-dimensional graphene by needle tip induction 广东墨睿科技有限公司 2022-02-18 CN claimed
US-20120065438-A1 Process for Syntheis of 10,10-Dibromo-9,9-dianthracene BEIJING AGLAIA TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2012-03-15 US claimed
US-20080138654-A1 Electroluminescent Materials and Devices OLED-T LIMTED (GB) 2008-06-12 US claimed
US-20230380267-A1 COMPOUNDS FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-11-23 US disclosed
US-20230371363-A1 COMPOUNDS THAT CAN BE USED FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-11-16 US disclosed
CN-114512644-B Positive electrode active material, preparation method thereof, positive electrode and lithium ion secondary battery 松山湖材料实验室 2023-10-20 CN disclosed
CN-116836033-A Improved ullmann coupling method 北京理工大学 2023-10-03 CN disclosed
CN-114914428-B High-first-effect hard carbon negative electrode material, preparation method thereof and sodium ion battery 大连中比动力电池有限公司 2023-07-28 CN disclosed
WO-2023079531-A1 METAL-ORGANIC FRAMEWORK BASED X-RAY IMAGING SCINTILLATOR KING ABDULLAH UNIVERSITY OF SCIENCE AND TECHNOLOGY (SA) 2023-05-11 WO disclosed
US-6582837-B1 Device having one or more organic thin layers including luminescent layer between anode and cathode, wherein at least one layer contains selected compound or compounds; exhibits higher-luminance luminescence than conventional device NEC CORPORATION (JP) 2003-06-24 US disclosed
US-20030072966-A1 Organic electrolumescence device IDEMITSU KOSAN CO., LTD. (JP) 2003-04-17 US disclosed
US-20020058156-A1 Substituted or unsubstituted cyclohexylidenemethine group compounds with improved hole injection properties SAMSUNG DISPLAY CO., LTD. (KR) 2002-05-16 US disclosed
US-20020048687-A1 Anthracene derivative and organic electroluminescence device using the derivative IDEMITSU KOSAN CO., LTD. (JP) 2002-04-25 US disclosed
EP-1182183-A1 ANTHRACENE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES MADE BY USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2002-02-27 EP disclosed
EP-1061112-A1 ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN COMPANY LIMITED (JP) 2000-12-20 EP 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-20030072966-A1 Organic electrolumescence device ABCC1, CCND1, JUND POLB 2030/4885ALDH1A1 273/4885TDP1 1805/4885
US-20230371363-A1 COMPOUNDS THAT CAN BE USED FOR STRUCTURING FUNCTIONAL LAYERS OF ORGANIC ELECTROLUMINESCENT DEVICES EPCAM, SELE, CTCF POLB 1810/4885ALDH1A1 705/4885TDP1 2507/4885
US-20080138654-A1 Electroluminescent Materials and Devices DDT, SLC18A2, SAT1 POLB 1486/4885ALDH1A1 1466/4885TDP1 2197/4885

“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.