SCHEMBL594044

SCHEMBL594044

CCCCC(OC)(OC)OC

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.35
LMNA P02545 1/20 0.35
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
THRB P10828 1/20 0.33
FDPS P14324 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 1/20 0.30

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
SCHEMBL11244658 0.91 TSHR (0.39) TSHRTHRBFDPS
SCHEMBL38663510 0.88 TSHR (0.44) TSHRTHRBFDPS
SCHEMBL20819823 0.88 TSHR (0.44) TSHRTHRBFDPS
SCHEMBL11253869 0.88 TSHR (0.44) TSHRTHRBFDPS
SCHEMBL32669051 0.88 TSHR (0.44) TSHRTHRBFDPS
Fluoride SCHEMBL29288700 0.86 TSHR (0.42) TSHRTHRBFDPS
SCHEMBL14779120 0.81 TSHR (0.35) TSHRLMNAESR1ESR2THRB
SCHEMBL594532 0.80 ALDH1A1 (0.35) TSHRALDH1A1TDP1
SCHEMBL16497589 0.78 TSHR (0.33) TSHRLMNATHRBFDPSALDH1A1
SCHEMBL10839797 0.77 TSHR (0.37) TSHRTHRBFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118619935-A Method for selectively protecting ortho-phenolic hydroxyl groups of tea polyphenol 浙江大学 2024-09-10 CN claimed
CN-118434672-A Method for removing water from bis (fluorosulfonyl) imide solution 法国特种经营公司 2024-08-02 CN claimed
CN-115043895-A PNU-159682 and preparation method of intermediate thereof 戊言医药科技(上海)有限公司 2022-09-13 CN claimed
CN-110698527-B Preparation method of high-purity hydrocortisone-17-valerate 湖南新合新生物医药有限公司 2022-08-26 CN claimed
US-20180280568-A1 POLY(THIOKETAL URETHANE) SCAFFOLDS AND METHODS OF USE VANDERBILT UNIVERSITY 2018-10-04 US claimed
EP-3362107-A1 POLY(THIOKETAL-URETHANE) SCAFFOLDS AND METHODS OF USE Vanderbilt University (US) 2018-08-22 EP claimed
WO-2017066670-A1 POLY(THIOKETAL-URETHANE) SCAFFOLDS AND METHODS OF USE VANDERBILT UNIVERSITY (US) 2017-04-20 WO claimed
EP-3036264-A1 HIGH MOLECULAR WEIGHT POLYMERS HAVING HIGH OLEFIN CONTENT Henkel IP & Holding GmbH (DE) 2016-06-29 EP claimed
WO-2015024236-A1 HIGH MOLECULAR WEIGHT POLYMERS HAVING HIGH OLEFIN CONTENT HENKEL CORPORATION (US) 2015-02-26 WO claimed
WO-2004000976-A2 FUEL ADDITIVE AND METHOD THEREFOR MILLENIUM FUELS, USA LLC (US) 2003-12-31 WO claimed
US-6514299-B1 Blends of acyclic alcohols and ethers, used to improve octane ratings of gasoline fuels; pollution control MILLENNIUM FUELS USA, LLC 2003-02-04 US claimed
US-4252738-A 1,2-Halohydrincarboxylic acid esters and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 1981-02-24 US claimed
EP-4719385-A2 1H-PYRAZOLO[3,4-D]PYRIMIDIN-4-AMINES AS ANTI-INFECTIOUS AGENTS University of Vermont and State Agricultural College (US) 2026-04-08 EP disclosed
US-12583861-B2 Derivatives of imidazo[4,5-d]pyridazine, their preparation and their therapeutic application SANOFI (FR) 2026-03-24 US disclosed
EP-4288438-B1 DERIVATIVES OF IMIDAZO[4,5-D]PYRIDAZINE, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2026-02-18 EP disclosed
WO-2025031923-A1 IMIDAZO[4,5-D]PYRIDAZINE COMPOUNDS AND CONJUGATES THEREOF, THEIR PREPARATION, AND THEIR THERAPEUTIC APPLICATIONS SANOFI (FR) 2025-02-13 WO disclosed
US-4315032-A ANTITHROMBOGENIC AGENTS, ANTIULCER AGENTS TEITIN LIMITED (JP) 1982-02-09 US disclosed
US-4252738-A 1,2-Halohydrincarboxylic acid esters and a process for their preparation BAYER AKTIENGESELLSCHAFT (DE) 1981-02-24 US disclosed
EP-0019475-A2 Process for preparing adjacently disubstituted ketones, novel prostaglandins E1 and anti-thrombotic compositions containing them TEIJIN LIMITED (JP) 1980-11-26 EP disclosed
US-4181720-A Corticosteroid antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1980-01-01 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 (1 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-12583861-B2 Derivatives of imidazo[4,5-d]pyridazine, their preparation and their therapeutic application TLR7, TLR8, TLR6 TSHR 672/4885LMNA 813/4885ESR1 2938/4885

“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.