SCHEMBL4584130

SCHEMBL4584130

O=C(O)c1scc(Br)c1Br

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.59
GPR35 Q9HC97 13/20 0.48
TSHR P16473 1/20 0.46
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTPN1 P18031 1/20 0.37
DAO P14920 1/20 0.37

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
SCHEMBL7041123 0.81 GSK3B (0.55) GSK3BGPR35TSHRDAO
SCHEMBL2690137 0.79 POLB (0.52) GSK3BGPR35TSHRPOLBTDP1
SCHEMBL2982713 0.78 GSK3B (0.57) GSK3BGPR35TSHRPOLB
SCHEMBL3281960 0.78 GPR35 (0.47) GSK3BGPR35TSHRPOLBTDP1
SCHEMBL1973884 0.78 GPR35 (0.47) GSK3BGPR35TSHRPOLBTDP1
SCHEMBL321098 0.76 GPR35 (0.60) GSK3BGPR35POLBTDP1L3MBTL1
SCHEMBL8135224 0.76 ALDH1A1 (0.47) GSK3BGPR35TSHRPOLBTDP1
SCHEMBL18152986 0.76 GPR35 (0.46) GSK3BGPR35TSHRPOLBTDP1
SCHEMBL6784082 0.75 GSK3B (1.00) GSK3BGPR35TSHRPTPN1
SCHEMBL16415737 0.74 GSK3B (0.48) GSK3BTSHRPOLBTDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118594613-A Hybrid aerogel-loaded polymer photocatalytic antibacterial agent and preparation method thereof 吉林师范大学 2024-09-06 CN claimed
CN-1069164-C Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 2001-08-08 CN claimed
CN-1305708-A Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 2001-08-01 CN claimed
EP-0755185-B1 Use of Dibromo-thiophen-carboxylic acid derivatives as microbicides BAYER AG (DE) 2000-12-13 EP claimed
US-5789437-A Microbicidal compositions based on dibromo-thiophene-carboxylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-08-04 US claimed
CN-1150378-A Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 1997-05-21 CN claimed
US-12133841-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof JS INNOMED HOLDINGS LTD. (KY) 2024-11-05 US disclosed
CN-118594613-A Hybrid aerogel-loaded polymer photocatalytic antibacterial agent and preparation method thereof 吉林师范大学 2024-09-06 CN disclosed
CN-112638917-B Heterocyclic compounds as kinase inhibitors, compositions comprising the same, and methods of use thereof 捷思英达控股有限公司 2023-09-08 CN disclosed
US-20210188868-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOMED HOLDINGS LTD. (KY) 2021-06-24 US disclosed
CN-112638917-A Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compounds, and methods of use thereof 捷思英达控股有限公司 2021-04-09 CN disclosed
EP-3797109-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS Innomed Holdings Ltd. (KY) 2021-03-31 EP disclosed
EP-1968568-A2 INHIBITORS OF Akt ACTIVITY SmithKline Beecham Corporation (US) 2008-09-17 EP disclosed
US-5789437-A Microbicidal compositions based on dibromo-thiophene-carboxylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
US-5789437-A Microbicidal compositions based on dibromo-thiophene-carboxylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1998-08-04 US disclosed
CN-1150378-A Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 1997-05-21 CN disclosed
CN-1150378-A Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 1997-05-21 CN disclosed
CN-1150378-A Microbicidal compositions of dibromo-thiophene-carboxylic acid derivatives BAYER AG (DE) 1997-05-21 CN disclosed
EP-0755185-A1 MICROBICIDAL AGENTS BASED ON DIBROMO-THIOPHENE-CARBOXYLIC ACID DERIVATIVES BAYER AG (DE) 1997-01-29 EP disclosed
WO-1995027397-A1 MICROBICIDAL AGENTS BASED ON DIBROMO-THIOPHENE-CARBOXYLIC ACID DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1995-10-19 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 (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-20210188868-A1 HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF MAP3K11, MAP3K13, MAP3K1 GSK3B 110/4885GPR35 2269/4885TSHR 3177/4885
US-12133841-B2 Heterocyclic compounds as kinase inhibitors, compositions comprising the heterocyclic compound, and methods of use thereof MAP3K11, MAP3K13, MAP3K1 GSK3B 110/4885GPR35 2269/4885TSHR 3177/4885

“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.