SCHEMBL9056384

SCHEMBL9056384

BrCCCCCOCCCCCBr

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
THRB P10828 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.32

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
SCHEMBL538551 1.00 MEN1 (0.36) MEN1THRBHTTKMT2AMAPT
SCHEMBL28458081 1.00 MEN1 (0.36) MEN1THRBHTTKMT2AMAPT
SCHEMBL11084551 1.00 MEN1 (0.36) MEN1THRBHTTKMT2AMAPT
SCHEMBL20667099 1.00 MEN1 (0.36) MEN1THRBHTTKMT2AMAPT
SCHEMBL17746740 1.00 MEN1 (0.36) MEN1THRBHTTKMT2AMAPT
SCHEMBL636678 0.96 TSHR (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL28626777 0.94 MEN1 (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL17746741 0.93 TSHR (0.33) MEN1THRBHTTKMT2AMAPT
SCHEMBL22689294 0.91 MAPT (0.37) MEN1THRBHTTKMT2AMAPT
SCHEMBL28626263 0.90

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220402854-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKENE ETHERS NEUROBO PHARMACEUTICALS INC (US) 2022-12-22 US disclosed
US-20220402854-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKENE ETHERS NEUROBO PHARMACEUTICALS INC (US) 2022-12-22 US disclosed
US-11447485-B2 Class of bifunctional compounds with quanternary ammonium salt structure BEIJING SHOWBY PHARMACEUTICAL CO., LTD. (CN) 2022-09-20 US disclosed
CN-111704543-A Process and intermediates for preparing alpha, omega-dicarboxylic acid terminated dialkyl ethers 燿石治疗公司 2020-09-25 CN disclosed
EP-3653598-A1 PROCESSES AND INTERMEDIATES FOR PREPARING , -DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS Gemphire Therapeutics Inc. (US) 2020-05-20 EP disclosed
EP-3653598-A1 PROCESSES AND INTERMEDIATES FOR PREPARING , -DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS Gemphire Therapeutics Inc. (US) 2020-05-20 EP disclosed
US-20200048181-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS NEUROBO PHARMACEUTICALS, INC. 2020-02-13 US disclosed
US-20200048181-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS NEUROBO PHARMACEUTICALS, INC. 2020-02-13 US disclosed
US-10227285-B2 Processes and intermediates for preparing alpha,omega-dicarboxylic acid-terminated dialkane ethers GEMPHIRE THERAPEUTICS INC. (US) 2019-03-12 US disclosed
US-10227285-B2 Processes and intermediates for preparing alpha,omega-dicarboxylic acid-terminated dialkane ethers GEMPHIRE THERAPEUTICS INC. (US) 2019-03-12 US disclosed
EP-2684878-A1 DIPYRIDYLAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-01-15 EP disclosed
WO-1996011901-A1 NOVEL α,α,α',α'-TETRACHLOROBICARBOXYLIC ACIDS, PROCESS FOR PRODUCING THEM AND MEDICAMENTS CONTAINING THEM BOEHRINGER MANNHEIM GMBH (DE) 1996-04-25 WO disclosed
US-5242943-A Administering as beta adrenoceptor blocking agents Louis, William J. (AU) 1993-09-07 US disclosed
US-5051445-A Cardiovascular disorders such as antiarrhythmia or cardiotonic agents, adrenergic blocking agents Louis, William J. (AU) 1991-09-24 US disclosed
EP-0177515-B1 3-AMINOPROPYLOXYPHENYL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Louis, William John (AU) 1989-05-31 EP disclosed
US-4816472-A ANTISECRETORY AGENTS ISTITUTO BIOCHEMICO ITALIANO GIOVANNI LORENZINI S.P.A. (IT) 1989-03-28 US disclosed
EP-0218953-A2 Derivatives of 19,20-bis-nor-prostanoic acid with antiulcer and anorectic activity, process for their preparation and pharmaceutical compositions thereof IBI- Istituto Biochimico Italiano Giovanni Lorenzini S.p.A. (IT) 1987-04-22 EP disclosed
EP-0177515-A4 3-AMINOPROPYLOXYPHENYL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. SANDOZ LTD (CH) 1986-09-23 EP disclosed
EP-0177515-A1 3-AMINOPROPYLOXYPHENYL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM. SANDOZ LTD (CH) 1986-04-16 EP disclosed
WO-1985004403-A1 3-AMINOPROPYLOXYPHENYL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ LTD. (CH) 1985-10-10 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 (4 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-20220402854-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKENE ETHERS ELOVL3, DGKI, ELOVL5 MEN1 1505/4885THRB 3184/4885HTT 4147/4885
US-11447485-B2 Class of bifunctional compounds with quanternary ammonium salt structure AGTR2, AGTR1, ADRB2 MEN1 3713/4885THRB 530/4885HTT 4292/4885
US-10227285-B2 Processes and intermediates for preparing alpha,omega-dicarboxylic acid-terminated dialkane ethers DGKI, DGKA, SQLE MEN1 1573/4885THRB 2774/4885HTT 3934/4885
US-20200048181-A1 PROCESSES AND INTERMEDIATES FOR PREPARING alpha,omega-DICARBOXYLIC ACID-TERMINATED DIALKANE ETHERS DGKI, DGKA, SQLE MEN1 1573/4885THRB 2774/4885HTT 3934/4885

“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.