SCHEMBL127904

SCHEMBL127904

O=C1OC(=O)c2c(Br)cc3c4c(c(Br)cc1c24)C(=O)OC3=O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
ALOX15 P16050 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TYMS P04818 2/20 0.37
ALDH1A1 P00352 2/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 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
SCHEMBL29768809 1.00 TSHR (0.42) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL4904796 0.96 TSHR (0.39) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL127961 0.93 TSHR (0.41) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL128103 0.92 TYMS (0.41) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL127148 0.92 TSHR (0.46) TSHRALOX15TDP1TYMS
SCHEMBL13713810 0.89 TSHR (0.34) TSHRALOX15TDP1TYMS
SCHEMBL23193252 0.80 TSHR (0.32) TSHR
SCHEMBL12744260 0.79 ALOX15 (0.40) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL855808 0.78 ALOX15 (0.48) TSHRALOX15TDP1TYMSALDH1A1
SCHEMBL854142 0.76 CA1 (0.46) TSHRALOX15TDP1TYMSALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023167234-A1 COMPOUND, ORGANIC THIN FILM, PHOTOELECTRIC CONVERSION ELEMENT, IMAGING ELEMENT, PHOTOSENSOR AND SOLID-STATE IMAGING DEVICE 三菱瓦斯化学株式会社 2023-09-07 WO disclosed
US-20230212166-A1 SUBSTITUTED NAPHTHALENE DIIMIDES AND THEIR USE UCL BUSINESS LTD (GB) 2023-07-06 US disclosed
US-20230212166-A1 SUBSTITUTED NAPHTHALENE DIIMIDES AND THEIR USE UCL BUSINESS LTD (GB) 2023-07-06 US disclosed
US-11696500-B2 Organic electroluminescent element, display device, illumination device, and pi-conjugated compound MERCK PATENT GMBH (DE) 2023-07-04 US disclosed
US-11696500-B2 Organic electroluminescent element, display device, illumination device, and pi-conjugated compound MERCK PATENT GMBH (DE) 2023-07-04 US disclosed
WO-2020229840-A1 SUBSTITUTED NAPHTHALENE DIIMIDES AND THEIR USE UCL BUSINESS PLC (GB) 2020-11-19 WO disclosed
EP-3355119-B1 ELECTROPHOTOGRAPHIC PHOTOSENSITIVE MEMBER, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS KYOCERA DOCUMENT SOLUTIONS INC (JP) 2020-09-30 EP disclosed
US-10655060-B2 Preparation method and application of fluorescent compound having sensing ability to aniline and o-toluidine gas, and fluorescent film with the same SHAANXI NORMAL UNIVERSITY (CN) 2020-05-19 US disclosed
US-10629815-B2 Conjugated polymers INNOVATIONLAB GMBH (DE) 2020-04-21 US disclosed
WO-2020060937-A1 NARROW ABSORPTION POLYMER NANOPARTICLES AND RELATED METHODS UNIVERSITY OF WASHINGTON (US) 2020-03-26 WO disclosed
US-20100311739-A1 Naphthalene Diimide Compounds UNIVERSITY COLLEGE LONDON (GB) 2010-12-09 US disclosed
WO-2010052287-A1 ORGANIC SEMICONDUCTING POLYMERS BASF SE (DE) 2010-05-14 WO disclosed
WO-2010006698-A1 CONJUGATED LOW BAND-GAP COPOLYMERS AND RELATIVE PREPARATION PROCESS ENI S.P.A. (IT) 2010-01-21 WO disclosed
WO-2009098253-A9 NAPHTHALENE-IMIDE SEMICONDUCTOR POLYMERS BASF SE (DE) 2009-10-15 WO disclosed
WO-2009098253-A1 NAPHTHALENE-IMIDE SEMICONDUCTOR POLYMERS BASF SE (DE) 2009-08-13 WO disclosed
WO-2009068916-A1 NAPHTHALENE DIIMIDE COMPOUNDS INTERACTING WITH G-QUADRUPLEX REGIONS IN DNA SCHOOL OF PHARMACY, UNIVERSITY OF LONDON (GB) 2009-06-04 WO disclosed
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors BASF SE (DE) 2008-12-04 US disclosed
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors BASF SE (DE) 2008-12-04 US disclosed
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors BASF SE (DE) 2008-12-04 US disclosed
WO-2007074137-A1 NAPHTHALENETETRACARBOXYLIC ACID DERIVATIVES AND THEIR USE AS SEMICONDUCTORS BASF SE (DE) 2007-07-05 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-20100311739-A1 Naphthalene Diimide Compounds NDC1, NUTF2, NDUFC2 TSHR 3748/4885ALOX15 2274/4885TDP1 1844/4885
US-10629815-B2 Conjugated polymers CDH1, OCIAD2, OCIAD1 TSHR 4196/4885ALOX15 1361/4885TDP1 1925/4885
US-20080300405-A1 Naphthalenetetracarboxylic Aicd Derivatives and their Use as Semiconductors ADSL, ALAD, EED TSHR 4522/4885ALOX15 2871/4885TDP1 4282/4885
US-10655060-B2 Preparation method and application of fluorescent compound having sensing ability to aniline and o-toluidine gas, and fluorescent film with the same DBI, PADI1, PADI4 TSHR 3973/4885ALOX15 3685/4885TDP1 1135/4885
US-20230212166-A1 SUBSTITUTED NAPHTHALENE DIIMIDES AND THEIR USE NDC1, DDB1, DDX21 TSHR 4561/4885ALOX15 3512/4885TDP1 70/4885

“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.