SCHEMBL17842

SCHEMBL17842

Oc1ccc(Cc2cc(Br)ccc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.46
MAPT P10636 2/20 0.46
KMT2A Q03164 2/20 0.46
SLC5A2 P31639 3/20 0.46
SLC5A1 P13866 1/20 0.46
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
KEAP1 Q14145 1/20 0.43
ALOX15 P16050 2/20 0.41
AGER Q15109 1/20 0.40
CCR5 P51681 2/20 0.39
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
THRB P10828 1/20 0.38
CASP1 P29466 1/20 0.38
HTT P42858 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL29816996 1.00 MEN1 (0.46) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL499287 0.86 SLC5A2 (0.38) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL12782162 0.85 CCR5 (0.47) MEN1MAPTKMT2ACCR5HTR2A
SCHEMBL500031 0.84 SLC6A4 (0.37) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL500175 0.83 CA2 (0.38) MAPTSLC5A2SLC5A1KDM4EALDH1A1
SCHEMBL3381486 0.83 ALOX15 (0.39) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL1457579 0.82 APP (0.40) MEN1MAPTKMT2ASLC5A2SLC5A1
SCHEMBL37715 0.82 SLC5A2 (0.47) MAPTSLC5A2SLC5A1CCR5KDM4E
SCHEMBL1539254 0.82 SLC5A2 (0.47) MAPTSLC5A2SLC5A1CCR5ALDH1A1
SCHEMBL10540001 0.81 MEN1 (0.58) MEN1MAPTKMT2ASLC5A2SLC5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116462670-A Method for preparing enggliflozin by one-pot method 福安药业集团重庆博圣制药有限公司 2023-07-21 CN claimed
CN-115073271-A Preparation method of 4' - (5-bromo-2-chlorobenzyl) phenol 苏州敬业医药化工有限公司 2022-09-20 CN claimed
US-20190202814-A1 PROCESSES FOR PREPARATION OF EMPAGLIFLOZIN CADILA HEALTHCARE LIMITED (IN) 2019-07-04 US claimed
US-20170247356-A1 PROCESSES FOR THE PREPARATION OF EMPAGLIFLOZIN CADILA HEALTHCARE LIMITED 2017-08-31 US claimed
EP-2360165-A2 GLUCOPYRANOSYL-SUBSTITUTED BENZENE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR MANUFACTURE Boehringer Ingelheim International GmbH (DE) 2011-08-24 EP claimed
EP-2295422-A2 Glucopyranosyl substituted benzol derivatives, pharmaceutical compositions containing these compounds, use thereof and method for their production Boehringer Ingelheim International GmbH (DE) 2011-03-16 EP claimed
CN-116462670-A Method for preparing enggliflozin by one-pot method 福安药业集团重庆博圣制药有限公司 2023-07-21 CN disclosed
CN-116462670-A Method for preparing enggliflozin by one-pot method 福安药业集团重庆博圣制药有限公司 2023-07-21 CN disclosed
WO-2023080243-A1 METHOD FOR PRODUCING C-ARYLGLUCOSIDE DERIVATIVE 株式会社トクヤマ 2023-05-11 WO disclosed
CN-108285439-B Carbonoside sodium glucose transport protein body 2 inhibitor 江苏天士力帝益药业有限公司 2023-05-02 CN disclosed
WO-2023005587-A1 SYNTHESIS METHOD FOR EMPAGLIFLOZIN KEY INTERMEDIATE 山东铂源药业股份有限公司 2023-02-02 WO disclosed
US-11548906-B2 Processes for the preparation of SGLT-2 inhibitors, intermediates thereof EMMENNAR PHARMA PRIVATE LIMITED (IN) 2023-01-10 US disclosed
CN-115073271-A Preparation method of 4' - (5-bromo-2-chlorobenzyl) phenol 苏州敬业医药化工有限公司 2022-09-20 CN disclosed
US-20060189548-A1 Glucopyranosyl-substituted ((hetero)arylethynyl-benzyl)-benzene derivatives, medicaments containing such compounds, their use and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-08-24 US disclosed
US-20060142210-A1 Glucopyranosyl-substituted benzene derivatives, medicaments containing such compounds, their use and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-29 US disclosed
WO-2006064033-A2 GLUCOPYRANOSYL-SUBSTITUTED BENZENE DERIVATIVES, MEDICAMENTS CONTAINING SUCH COMPOUNDS, THEIR USE AND PROCESS FOR THEIR MANUFACTURE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-06-22 WO disclosed
WO-2006002912-A1 D-XYLOPYRANOSYL-SUBSTITUTED PHENYLS, MEDICAMENTS CONTAINING SAID COMPOUNDS, THE USE THEREOF, AND METHODS FOR PRODUCING THE SAME BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-01-12 WO disclosed
US-20060009400-A1 D-xylopyranosyl-substituted phenyl derivatives, medicaments containing such compounds, their use and process for their manufacture BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2006-01-12 US disclosed
WO-2005092877-A1 GLUCOPYRANOSYL-SUBSTITUTED BENZOL DERIVATIVES, DRUGS CONTAINING SAID COMPOUNDS, THE USE THEREOF AND METHOD FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-10-06 WO disclosed
US-20050209166-A1 Metabolic disorders like diabetes; inhibits sodium-dependent glucose cotransporter; 1-chloro-2-(4-cyclopentyloxybenzyl)-4-( beta -D-glucopyranos-1-yl)-benzene BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-09-22 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 (7 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-20190202814-A1 PROCESSES FOR PREPARATION OF EMPAGLIFLOZIN SLC5A2, SLC5A1, SLC2A4 MEN1 3121/4885MAPT 1111/4885KMT2A 2864/4885
US-20060189548-A1 Glucopyranosyl-substituted ((hetero)arylethynyl-benzyl)-benzene derivatives, medicaments containing such compounds, their use and process for their manufacture UGGT1, UGT2B7, GPR119 MEN1 2572/4885MAPT 977/4885KMT2A 3337/4885
US-20050209166-A1 Metabolic disorders like diabetes; inhibits sodium-dependent glucose cotransporter; 1-chloro-2-(4-cyclopentyloxybenzyl)-4-( beta -D-glucopyranos-1-yl)-benzene SLC5A1, SLC5A2, SLC2A1 MEN1 2381/4885MAPT 1274/4885KMT2A 3844/4885
US-20170247356-A1 PROCESSES FOR THE PREPARATION OF EMPAGLIFLOZIN SLC5A2, SLC5A1, SLC2A4 MEN1 3100/4885MAPT 1216/4885KMT2A 2810/4885
US-20060009400-A1 D-xylopyranosyl-substituted phenyl derivatives, medicaments containing such compounds, their use and process for their manufacture SLC5A1, SLC5A2, SLC2A1 MEN1 3825/4885MAPT 1457/4885KMT2A 1445/4885
US-20060142210-A1 Glucopyranosyl-substituted benzene derivatives, medicaments containing such compounds, their use and process for their manufacture UGGT1, SLC5A1, SLC5A2 MEN1 2784/4885MAPT 427/4885KMT2A 3947/4885
US-11548906-B2 Processes for the preparation of SGLT-2 inhibitors, intermediates thereof SLC5A2, SLC5A1, SLC2A4 MEN1 3459/4885MAPT 340/4885KMT2A 1979/4885

“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.