SCHEMBL3413686

SCHEMBL3413686

C=C(C)C(=O)OCCCCBr

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.66
TDP1 Q9NUW8 2/20 0.53
POLB P06746 1/20 0.53
APEX1 P27695 1/20 0.53
HTT P42858 1/20 0.53
THRB P10828 1/20 0.52
ALDH1A1 P00352 4/20 0.40
CYP3A4 P08684 1/20 0.34
FAAH O00519 1/20 0.34
NAAA Q02083 1/20 0.32
RAD52 P43351 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HPGD P15428 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EPHX1 P07099 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
SCHEMBL9131805 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL28319571 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL9132044 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL5702900 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL9133801 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL24205467 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL9131789 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL2397960 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL22325602 0.98 TSHR (0.69) TSHRTDP1POLBAPEX1HTT
SCHEMBL9136941 0.96 TSHR (0.67) TSHRTDP1POLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116903876-A Preparation method and application of malonic acid precursor polymer nano-drug 山西白求恩医院(山西医学科学院、华中科技大学同济医学院附属同济医院山西医院、山西医科大学第三医院、山西医科大学第三临床医学院) 2023-10-20 CN claimed
CN-101193928-B Novel packing material with excellent hydrophilicity and process for producing the same TOSOH CORP 2011-07-20 CN claimed
EP-1889857-B1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME TOSOH CORP (JP) 2010-07-21 EP claimed
US-20100029914-A1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME TOSOH CORPORATION (JP) 2010-02-04 US claimed
CN-101193928-A Novel packing material with excellent hydrophilicity and process for producing the same TOSOH CORP (JP) 2008-06-04 CN claimed
EP-1889857-A1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME Tosoh Corporation (JP) 2008-02-20 EP claimed
EP-4641589-A1 POLYMER ELECTROLYTE AND SECONDARY BATTERY Canon Kabushiki Kaisha (JP) 2025-10-29 EP disclosed
EP-4625582-A1 POLYMER ELECTROLYTE AND SECONDARY BATTERY CANON KABUSHIKI KAISHA (JP) 2025-10-01 EP disclosed
US-20250279471-A1 POLYMER ELECTROLYTE AND SECONDARY BATTERY CANON KABUSHIKI KAISHA (JP) 2025-09-04 US disclosed
WO-2024135777-A1 POLYMER ELECTROLYTE AND SECONDARY BATTERY キヤノン株式会社 2024-06-27 WO disclosed
WO-2024111618-A1 POLYMER ELECTROLYTE AND SECONDARY BATTERY キヤノン株式会社 2024-05-30 WO disclosed
CN-116903876-A Preparation method and application of malonic acid precursor polymer nano-drug 山西白求恩医院(山西医学科学院、华中科技大学同济医学院附属同济医院山西医院、山西医科大学第三医院、山西医科大学第三临床医学院) 2023-10-20 CN disclosed
US-20230273455-A1 OPTICALLY ACTIVE DEVICES JOHNSON & JOHNSON SURGICAL VISION INC (US) 2023-08-31 US disclosed
CN-101685255-A Coloring photosensitive composition, color filter and liquid crystal display FUJI PHOTO FILM CO LTD 2010-03-31 CN disclosed
US-20100029914-A1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME TOSOH CORPORATION (JP) 2010-02-04 US disclosed
CN-101637999-A Recording method, recorded matter, ink jet recording apparatus, and identification method SEIKO EPSON CORP JP 2010-02-03 CN disclosed
WO-2009069848-A1 NOVEL COPOLYMERS AND PHOTORESIST COMPOSITION INCLUDING THE SAME CHEIL INDUSTRIES INC. (KR) 2009-06-04 WO disclosed
CN-101396909-A Coater and ink-jet recording device using the same FUJIFILM CORP (JP) 2009-04-01 CN disclosed
CN-101193928-A Novel packing material with excellent hydrophilicity and process for producing the same TOSOH CORP (JP) 2008-06-04 CN disclosed
EP-1889857-A1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME Tosoh Corporation (JP) 2008-02-20 EP 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-20100029914-A1 NOVEL PACKING MATERIAL WITH EXCELLENT HYDROPHILICITY AND PROCESS FOR PRODUCING THE SAME ADH5, ADH1A, ADH1C TSHR 1351/4885TDP1 3852/4885POLB 2766/4885
US-20230273455-A1 OPTICALLY ACTIVE DEVICES PDE6C, PDE6A, PDE6D TSHR 4592/4885TDP1 2946/4885POLB 1376/4885

“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.