SCHEMBL787220

SCHEMBL787220

CC(C)(O)C(C)(C)O.CC(C)(O)C(C)(C)O.OBO

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
ALDH1A1 P00352 2/20 0.33
TSHR P16473 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
SCHEMBL22470611 1.00 THRB (0.43) THRBALDH1A1TSHR
SCHEMBL194318 1.00 THRB (0.43) THRBALDH1A1TSHR
SCHEMBL6225188 0.88 THRB (0.35) THRB
SCHEMBL8968 0.84
SCHEMBL27028519 0.84 THRB (0.55) THRBALDH1A1TSHR
SCHEMBL504018 0.84 THRB (0.55) THRBALDH1A1TSHR
Water SCHEMBL3827178 0.78 THRB (0.50) THRBALDH1A1TSHR
SCHEMBL402114 0.78 THRB (0.50) THRBALDH1A1TSHR
SCHEMBL789340 0.78
SCHEMBL3230777 0.78 THRB (0.50) THRBALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115894463-A Preparation method of ROCK inhibitor, intermediate thereof and preparation method of intermediate 武汉朗来科技发展有限公司 2023-04-04 CN claimed
CN-114516779-B Selective functionalization method of bicycloheptatriene-rubine (DHR) and derivatization application thereof 中国科学院化学研究所 2023-03-31 CN claimed
CN-115413277-A Solid forms of pyrazine-substituted nicotinamide, their preparation and use 深圳市塔吉瑞生物医药有限公司 2022-11-29 CN claimed
CN-114853787-A Near-infrared two-region AIE molecular probe and preparation method and application thereof 河南大学 2022-08-05 CN claimed
CN-111087357-B Preparation method of Prisamod 中国医学科学院药物研究所 2022-07-19 CN claimed
CN-114685546-A Hypochlorous acid fluorescence chemical sensor based on ICT and FRET mechanisms and synthetic method and application thereof 青海师范大学 2022-07-01 CN claimed
CN-113717396-B Copper (I) -based covalent metal organic framework material for catalyzing hydroboration reaction of alkyne and preparation method thereof 暨南大学 2022-02-22 CN claimed
US-20260116903-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND USE THEREOF RECURSION PHARMACEUTICALS INC (US) 2026-04-30 US disclosed
US-12540149-B2 Aromatic heterocyclic compound, pharmaceutical composition, and use thereof RECURSION PHARMACEUTICALS, INC. (US) 2026-02-03 US disclosed
WO-2025108411-A1 EP300/CBP REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 北京沐华生物科技有限责任公司 2025-05-30 WO disclosed
WO-2025045233-A1 MACROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR, AND USE THEREOF 劲方医药科技(上海)股份有限公司 2025-03-06 WO disclosed
CN-119522224-A Preparation method and application of nitrogenous heterocyclic compound as ubiquitin-specific protease 1 inhibitor and application thereof 上海济煜医药科技有限公司 2025-02-25 CN disclosed
WO-2025016323-A1 PROTEIN ARGINASE METHYLTRANSFERASE-5 INHIBITOR AND MEDICAL USE THEREOF 江苏亚虹医药科技股份有限公司 2025-01-23 WO disclosed
CN-108003140-A Organic molecules particularly suitable for use in organic opto-electronic devices 辛诺拉有限公司 2018-05-08 CN disclosed
US-9611222-B2 Pyridine compounds and the uses thereof PURDUE PHARMA L.P. (US) 2017-04-04 US disclosed
US-20150259293-A1 PYRIDINE COMPOUNDS AND THE USES THEREOF PURDUE PHARMA L.P. 2015-09-17 US disclosed
US-9056832-B2 Pyridine compounds and the users thereof PURDUE PHARMA L.P. (US) 2015-06-16 US disclosed
US-20130303526-A1 Pyridine Compounds and the Uses Thereof PURDUE PHARMA L.P. (US) 2013-11-14 US disclosed
EP-2616441-A2 PYRIDINE COMPOUNDS AND THE USES THEREOF Purdue Pharma LP (US) 2013-07-24 EP disclosed
WO-2012035421-A2 PYRIDINE COMPOUNDS AND THE USES THEREOF PURDUE PHARMA L.P. (US) 2012-03-22 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-20150259293-A1 PYRIDINE COMPOUNDS AND THE USES THEREOF TRPV1, CACNA1A, KCNA1 THRB 2089/4885ALDH1A1 172/4885TSHR 1995/4885
US-12540149-B2 Aromatic heterocyclic compound, pharmaceutical composition, and use thereof CDK7, CDK17, CDK1 THRB 2317/4885ALDH1A1 4510/4885TSHR 3070/4885
US-20260116903-A1 AROMATIC HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND USE THEREOF CDK7, CDK8, CDK6 THRB 1976/4885ALDH1A1 3407/4885TSHR 1386/4885
US-20130303526-A1 Pyridine Compounds and the Uses Thereof TRPV1, CACNA1A, KCNA1 THRB 2089/4885ALDH1A1 172/4885TSHR 1995/4885

“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.