SCHEMBL723007

SCHEMBL723007

CC(C)(CO)CO.CCOC(C)OCC

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
THRB P10828 1/20 0.35

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
SCHEMBL20656759 0.84 LMNA (0.43) LMNA
SCHEMBL2275801 0.82 LMNA (0.63) LMNATHRB
Alcohol SCHEMBL1490179 0.81 LMNA (0.80) LMNATHRB
SCHEMBL9295759 0.79 LMNA (0.67) LMNATHRB
Ethylene Glycol SCHEMBL356222 0.78 LMNA (0.75) LMNATHRB
SCHEMBL7042976 0.78 LMNA (0.57) LMNATHRB
Methyl Alcohol SCHEMBL5434659 0.78 LMNA (0.86) LMNATHRB
SCHEMBL2094168 0.78 LMNA (1.00) LMNATHRB
SCHEMBL9459 0.78
SCHEMBL11288604 0.77 LMNA (0.63) LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112537998-B Process for producing neopentyl glycol by continuous catalytic hydrogenation 上海翼湍科技有限责任公司 2022-12-23 CN claimed
CN-112537998-A Process for producing neopentyl glycol by continuous catalytic hydrogenation 上海翼湍科技有限责任公司 2021-03-23 CN claimed
CN-103351277-B Neopentyl glycol preparation method WANHUA CHEMICAL GROUP CO LTD 2014-12-31 CN claimed
CN-103351277-A Neopentyl glycol preparation method WANHUA CHEMICAL GROUP CO LTD 2013-10-16 CN claimed
CN-118239948-A Solid forms and methods of making fused tricyclic compounds, including methods of use thereof 豪夫迈·罗氏有限公司 2024-06-25 CN disclosed
CN-117946107-A Solid forms and methods of making fused tricyclic compounds, including methods of use thereof 豪夫迈·罗氏有限公司 2024-04-30 CN disclosed
EP-4295845-A2 SOLID FORMS OF THE TARTRATE SALT OF 3-((1R,3R)-1-(2,6-DIFLUORO-4-((1-(3-FLUOROPROPYL)AZETIDIN-3-YL)AMINO)PHENYL)-3-METHYL-1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOL-2-YL)-2,2-DIFLUOROPROPAN-1-OL, PROCESS FOR THEIR PREPARATION AND METHODS OF THEIR USE IN TREATING CANCERS F. Hoffmann-La Roche AG (CH) 2023-12-27 EP disclosed
US-11780834-B2 Solid forms of 3-((1R,3R)-1-(2,6-difluoro-4-((1-(3-fluoropropyl)azetidin-3- yl)amino)phenyl)-3-methyl-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-2,2-difluoropropan-1-ol and processes for preparing fused tricyclic compounds comprising a substituted phenyl or pyridinyl moiety, including methods of their use GENENTECH, INC. (US) 2023-10-10 US disclosed
EP-3810283-B1 SOLID FORMS OF THE TARTRATE SALT OF 3-((1R,3R)-1-(2,6-DIFLUORO-4-((1-(3-FLUOROPROPYL)AZETIDIN-3-YL)AMINO)PHENYL)-3-METHYL-1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOL-2-YL)-2,2-DIFLUOROPROPAN-1-OL, PROCESS FOR THEIR PREPARATION AND METHODS OF THEIR USE IN TREATING CANCERS HOFFMANN LA ROCHE (CH) 2023-06-14 EP disclosed
CN-112537998-B Process for producing neopentyl glycol by continuous catalytic hydrogenation 上海翼湍科技有限责任公司 2022-12-23 CN disclosed
CN-111822050-B Carbonylation reaction catalyst composition and method for preparing neopentyl glycol 万华化学集团股份有限公司 2022-07-12 CN disclosed
CN-112755932-A System for continuously synthesizing hydroxypivalaldehyde 中国五环工程有限公司 2021-05-07 CN disclosed
US-20030092775-A1 Process for the preparation of meso-zeaxanthin BASF AKTIENGESELLSCHAFT (DE) 2003-05-15 US disclosed
CN-1406933-A Meso cryptoxanthine preparation BASF AG (DE) 2003-04-02 CN disclosed
CN-1156440-A Method for producing acyloins BASF AG (DE) 1997-08-06 CN disclosed
US-5276209-A Preparation of polyenes BASF AKTIENGESELLSCHAFT (DE) 1994-01-04 US disclosed
US-5126500-A PREPARATION OF RETINYL GLYCOSIDES AND INTERMEDIATES THEREFOR BASF AKTIENGESELLSCHAFT (DE) 1992-06-30 US disclosed
US-4851425-A Cyclopentapyrazole and tetrahydroindazole compounds and their use as anti-inflammatory and anti-allergic agents THE UPJOHN COMPANY (US) 1989-07-25 US disclosed
WO-1986007357-A3 CYCLOPENTAPYRAZOLE AND TETRAHYDROINDAZOLE COMPOUNDS THE UPJOHN COMPANY (US) 1987-04-23 WO disclosed
US-3966751-A Oxazolidines of 4-oxo-tricyclo[5.1.02.5 ]octan-8-endo-carboxaldehyde, neopentyl glycol acetal THE UPJOHN COMPANY (US) 1976-06-29 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 (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-11780834-B2 Solid forms of 3-((1R,3R)-1-(2,6-difluoro-4-((1-(3-fluoropropyl)azetidin-3- yl)amino)phenyl)-3-methyl-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-2,2-difluoropropan-1-ol and processes for preparing fused tricyclic compounds comprising a substituted phenyl or pyridinyl moiety, including methods of their use TP53, DPYD, FLI1 LMNA 2912/4885THRB 1182/4885
US-20030092775-A1 Process for the preparation of meso-zeaxanthin CYP8B1, MTX1, CYP11A1 LMNA 1136/4885THRB 1108/4885

“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.