SCHEMBL346398

SCHEMBL346398

Brc1cc2ccccc2s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.48
HDAC4 P56524 1/20 0.48
HDAC1 Q13547 1/20 0.48
HDAC7 Q8WUI4 1/20 0.48
HDAC2 Q92769 1/20 0.48
HDAC10 Q969S8 1/20 0.48
HDAC11 Q96DB2 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HDAC9 Q9UKV0 1/20 0.48
HDAC5 Q9UQL6 1/20 0.48
CYP2A6 P11509 4/20 0.48
ASIC3 Q9UHC3 1/20 0.48
LOXL2 Q9Y4K0 1/20 0.48
MGLL Q99685 1/20 0.48
BCL2L1 Q07817 1/20 0.47
CA2 P00918 2/20 0.45
APP P05067 2/20 0.44
AGXT P21549 1/20 0.44
ADRB2 P07550 1/20 0.44

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
SCHEMBL29576829 1.00 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9380333 0.83 CA2 (0.39) HDAC3HDAC4HDAC1HDAC7HDAC2
Carbazole SCHEMBL28454963 0.83 ALDH1A1 (0.48) CNR1
SCHEMBL329715 0.75 AGXT (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL16482581 0.74 F9 (0.54)
SCHEMBL845603 0.74 APP (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL29732980 0.74 APP (0.63) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18878582 0.73 CYP2A6 (0.41) CYP2A6APP
SCHEMBL7632717 0.73 AGXT (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL15391504 0.73 ESR1 (0.39) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119751472-A Fluorescein derivative and preparation method and application thereof 湖北新德晟材料科技有限公司 2025-04-04 CN claimed
CN-115716837-B Preparation method and application of quaternary ammonium salt template agent and titanium silicalite molecular sieve 万华化学集团股份有限公司 2024-06-25 CN claimed
CN-118221736-A Synthesis method of bis (2-benzothienyl) phosphorus chloride 浙江九洲药业股份有限公司 2024-06-21 CN claimed
CN-111278837-B Hydrocarbon-soluble halogen and thiol/magnesium exchange reagent 雅宝德国有限责任公司 2024-04-09 CN claimed
CN-117776830-A Full deuteration preparation method of polycyclic aromatic hydrocarbon 宁波萃英化学技术有限公司 2024-03-29 CN claimed
EP-3688000-B1 HYDROCARBON-SOLUBLE HALOGEN AND THIOLATE/MAGNESIUM EXCHANGE REAGENTS ALBEMARLE GERMANY GMBH (DE) 2023-11-08 EP claimed
CN-116284134-A Self-assembled hole transport material containing benzothiophene element, synthesis method and application 西湖大学 2023-06-23 CN claimed
WO-2022205592-A1 BENZOTHIOPHENE BENZO FIVE-MEMBERED HETEROCYCLE MATERIAL, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 北京大学深圳研究生院 2022-10-06 WO claimed
US-11236113-B2 Hydrocarbon-soluble halogen and thiolate/magnesium exchange reagents ALBEMARLE GERMANY GMBH (DE) 2022-02-01 US claimed
CN-113121560-A Benzothienobenzo five-membered heterocyclic material and preparation method and application thereof 北京大学深圳研究生院 2021-07-16 CN claimed
EP-3688000-A1 HYDROCARBON-SOLUBLE HALOGEN AND THIOLATE/MAGNESIUM EXCHANGE REAGENTS Albemarle Germany GmbH (DE) 2020-08-05 EP claimed
US-20200239496-A1 Hydrocarbon-Soluble Halogen and Thiolate/Magnesium Exchange Reagents Ludwig-Maximilians-Universitat München (DE) 2020-07-30 US claimed
CN-111278837-A Hydrocarbon-soluble halogen and thiolate/magnesium exchange reagents 雅宝德国有限责任公司 2020-06-12 CN claimed
CN-208599203-U Bromobenzothiophene vacuum concentration equipment 郑州凡尔赛特化工有限公司 2019-03-15 CN claimed
CN-208599224-U Bromobenzothiophene extraction equipment 郑州凡尔赛特化工有限公司 2019-03-15 CN claimed
CN-108083393-A The graphite electrode modified based on PbO-NiO-MgO and thiophene 光合强化(北京)生物科技有限公司 2018-05-29 CN claimed
CN-103261189-B Amino-pyrrolidine-azetidine diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV 2015-01-28 CN claimed
US-12391659-B2 Benzothiazole and related compounds SPINOGENIX, INC. (US) 2025-08-19 US disclosed
US-4249014-A ANALGESICS, ANTISPASMODICS, ANTIINFLAMMATORY VASODILATORS INNOTHERA (FR) 1981-02-03 US disclosed
US-4186136-A COAGULANTS, ANTISPASMODIC AGENTS, ANALGESICS, ANTIINGLAMMATORY AGENTS, VASODILATION INNOTHERA (FR) 1980-01-29 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 (3 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-20200239496-A1 Hydrocarbon-Soluble Halogen and Thiolate/Magnesium Exchange Reagents OR10J3, MSRB3, SLC39A3 HDAC3 3960/4885HDAC4 4171/4885HDAC1 3899/4885
US-12391659-B2 Benzothiazole and related compounds BACE1, APP, BACE2 HDAC3 4490/4885HDAC4 3369/4885HDAC1 4128/4885
US-11236113-B2 Hydrocarbon-soluble halogen and thiolate/magnesium exchange reagents MSRB3, OR10J3, GFER HDAC3 4109/4885HDAC4 4214/4885HDAC1 3809/4885

“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.