SCHEMBL15218472

SCHEMBL15218472

Cc1c(Cl)ccc(Cl)c1Br

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
CES1 P23141 1/20 0.34
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 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
SCHEMBL8762239 0.83 ALDH1A1 (0.41) ALDH1A1CES1MAPT
SCHEMBL21459542 0.83 NCEH1 (0.37) ALDH1A1CES1MAPTMEN1KMT2A
SCHEMBL4975220 0.83 ALDH1A1 (0.31) ALDH1A1
SCHEMBL31636541 0.79 ALDH1A1 (0.48) ALDH1A1MEN1KMT2A
SCHEMBL21050679 0.79 ALDH1A1 (0.48) ALDH1A1MEN1KMT2A
SCHEMBL23226962 0.79 CYP3A4 (0.42) ALDH1A1MAPTMEN1KMT2A
SCHEMBL15476296 0.79 CYP3A4 (0.42) ALDH1A1MAPTMEN1KMT2A
SCHEMBL15497515 0.79 RAPGEF4 (0.32) MEN1KMT2A
SCHEMBL10989519 0.79 ALDH1A1 (0.48) ALDH1A1MEN1KMT2A
SCHEMBL6681654 0.77 ALDH1A1 (0.48) ALDH1A1CES1MAPTCYP1A2CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109761787-A The preparation method of the chloro- 2 bromo toluene of 3,6- bis- and the preparation method of dicamba 山东润博生物科技有限公司 2019-05-17 CN claimed
US-10442990-B2 Mesogenic compounds, liquid crystal media and components for high frequency technology MERCK PATENT GMBH (DE) 2019-10-15 US disclosed
CN-109761787-A The preparation method of the chloro- 2 bromo toluene of 3,6- bis- and the preparation method of dicamba 山东润博生物科技有限公司 2019-05-17 CN disclosed
US-9938462-B2 Liquid-crystalline media, components for high-frequency technology, and mesogenic compounds MERCK PATENT GMBH (DE) 2018-04-10 US disclosed
US-9765259-B2 Mesogenic compounds, liquid-crystalline media and components for high-frequency technology MERCK PATENT GMBH (DE) 2017-09-19 US disclosed
US-9752077-B2 Liquid-crystalline media, components for high-frequency technology, and mesogenic compounds MERCK PATENT GMBH (DE) 2017-09-05 US disclosed
US-9605204-B2 Liquid crystal medium and high frequency components comprising same MERCK PATENT GMBH (DE) 2017-03-28 US disclosed
US-9523037-B2 Liquid-crystalline media, components for high-frequency technology, and mesogenic compounds MERCK PATENT GMBH (DE) 2016-12-20 US disclosed
US-9296948-B2 Mesogenic compounds, liquid-crystalline media and components for high-frequency technology MERCK PATENT GMBH (DE) 2016-03-29 US disclosed
US-20160002533-A1 LIQUID-CRYSTALLINE MEDIA, COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY, AND MESOGENIC COMPOUNDS MERCK PATENT GMBH (DE) 2016-01-07 US disclosed
US-20150322344-A1 LIQUID-CRYSTALLINE MEDIA, COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY, AND MESOGENIC COMPOUNDS MERCK PATENT GMBH (DE) 2015-11-12 US disclosed
US-8999198-B2 Compounds for a liquid-crystalline medium, and the use thereof for high-frequency components MERCK PATENT GMBH (DE) 2015-04-07 US disclosed
US-20140021409-A1 MESOGENIC COMPOUNDS, LIQUID-CRYSTALLINE MEDIA AND COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY MERCK PATENT GMBH (DE) 2014-01-23 US disclosed
US-20140021405-A1 MESOGENIC COMPOUNDS, LIQUID-CRYSTALLINE MEDIA AND COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY MERCK PATENT GMBH (DE) 2014-01-23 US disclosed
US-20130221274-A1 COMPOUNDS FOR A LIQUID-CRYSTALLINE MEDIUM, AND THE USE THEREOF FOR HIGH-FREQUENCY COMPONENTS MERCK PATENT GMBH (DE) 2013-08-29 US 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 (2 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-20150322344-A1 LIQUID-CRYSTALLINE MEDIA, COMPONENTS FOR HIGH-FREQUENCY TECHNOLOGY, AND MESOGENIC COMPOUNDS MIF, SFRP1, MCM3 ALDH1A1 4410/4885CES1 4770/4885MAPT 709/4885
US-20130221274-A1 COMPOUNDS FOR A LIQUID-CRYSTALLINE MEDIUM, AND THE USE THEREOF FOR HIGH-FREQUENCY COMPONENTS CRY1, WIZ, HCN3 ALDH1A1 3044/4885CES1 3674/4885MAPT 2664/4885

“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.