SCHEMBL2399704

SCHEMBL2399704

OB(O)c1cccc2c(B(O)O)cccc12

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
ENPP2 Q13822 5/20 0.44
LIPE Q05469 1/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2A6 P11509 1/20 0.38
ORAI1 Q96D31 1/20 0.37
ORAI2 Q96SN7 1/20 0.37
ORAI3 Q9BRQ5 1/20 0.37
LIPG Q9Y5X9 1/20 0.37
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36

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
SCHEMBL29595177 1.00 MAPT (0.44) MAPTENPP2LIPECYP1A2CYP2A6
SCHEMBL29875461 0.88 MAPT (0.50) MAPTENPP2LIPECYP1A2ORAI1
SCHEMBL1427222 0.88 MAPT (0.50) MAPTENPP2LIPECYP1A2ORAI1
SCHEMBL15369531 0.87 CYP1A2 (0.62) MAPTENPP2CYP1A2CYP2A6CA7
SCHEMBL29954360 0.87 IDO1 (0.48) MAPTCYP1A2CA6
SCHEMBL12807507 0.87 MAPT (0.38) MAPTENPP2LIPECYP1A2CYP2A6
SCHEMBL29950871 0.87 CYP1A2 (0.62) MAPTENPP2CYP1A2CYP2A6CA7
SCHEMBL31621070 0.85 ENPP2 (0.40) MAPTENPP2LIPE
SCHEMBL3421359 0.85 CYP1A2 (0.41) MAPTENPP2LIPECYP1A2ORAI1
SCHEMBL17728135 0.85 MAPT (0.36) MAPTENPP2LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023206427-A1 SECONDARY BATTERY, BATTERY MODULE COMPRISING SAME, BATTERY PACK, AND ELECTRIC DEVICE 宁德时代新能源科技股份有限公司 2023-11-02 WO disclosed
WO-2023206360-A1 SECONDARY BATTERY AND BATTERY MODULE COMPRISING SAME, BATTERY PACK, AND ELECTRICAL DEVICE 宁德时代新能源科技股份有限公司 2023-11-02 WO disclosed
CN-115819466-A Binuclear iridium complex and application thereof in organic electronic device 广州追光科技有限公司 2023-03-21 CN disclosed
CN-111094295-B Novel compound and organic light emitting device comprising the same 株式会社LG化学 2022-05-17 CN disclosed
CN-111094295-A Novel compound and organic light emitting device comprising the same 株式会社LG化学 2020-05-01 CN disclosed
EP-1957606-B1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINIESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-08 EP disclosed
US-9017825-B2 Anthracene derivatives and their use in organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-28 US disclosed
US-9017825-B2 Anthracene derivatives and their use in organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-04-28 US disclosed
US-8173273-B2 Anthracene derivatives, method for preparation thereof, and organic electronic device using the same LG CHEM, LTD. (KR) 2012-05-08 US disclosed
US-8021766-B2 layer containing an organic compound sandwiched between the pair of electrodes; high color purity, high efficiency, high luminance, and a long life; nonaggregate; cost efficiency CANON KABUSHIKI KAISHA (JP) 2011-09-20 US disclosed
US-20100044681-A1 Novel Anthracene Derivatives, Method for Preparation Thereof, and Organic Electronic Device Using the Same LG CHEM, LTD. (KR) 2010-02-25 US disclosed
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 US disclosed
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2008-12-11 US disclosed
WO-2007123339-A9 NOVEL ANTHRACENE DERIVATIVES, METHOD FOR PREPARATION THEREOF, AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEMICAL LTD (KR) 2008-12-11 WO disclosed
US-20080286611-A1 BENZO(GHI)FLUORANTHENE DERIVATIVE AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME CANON KABUSHIKI KAISHA (JP) 2008-11-20 US disclosed
WO-2007123339-A1 NOVEL ANTHRACENE DERIVATIVES, METHOD FOR PREPARATION THEREOF, AND ORGANIC ELECTRONIC DEVICE USING THE SAME LG CHEM, LTD. (KR) 2007-11-01 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 (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-20080286611-A1 BENZO(GHI)FLUORANTHENE DERIVATIVE AND ORGANIC LIGHT EMITTING DEVICE USING THE SAME GTF2I, FLI1, GLB1 MAPT 2285/4885ENPP2 4252/4885LIPE 241/4885
US-20100044681-A1 Novel Anthracene Derivatives, Method for Preparation Thereof, and Organic Electronic Device Using the Same XPOT, TOMM22, TIMM10 MAPT 2318/4885ENPP2 300/4885LIPE 3249/4885
US-20080303423-A1 Novel Materials For Organic Electroluminescent Devices ANXA2, ANXA7, ANXA1 MAPT 2454/4885ENPP2 926/4885LIPE 4276/4885

“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.