SCHEMBL1921976

SCHEMBL1921976

C1CCOOC1.COC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50

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
Tetrahydrofuran SCHEMBL360933 0.81 ALDH1A1 (0.50) ALDH1A1
Tetrahydrofuran SCHEMBL28159237 0.79 ALDH1A1 (0.47) ALDH1A1
SCHEMBL1921973 0.79 ALDH1A1 (0.47) ALDH1A1
Chloromethane SCHEMBL28230379 0.75
Cyclohexane SCHEMBL357093 0.75 ALDH1A1 (0.73) ALDH1A1
Magnesium SCHEMBL31402253 0.75
Tert-Butanol SCHEMBL6023370 0.73
Dioxane SCHEMBL1921978 0.73 ALDH1A1 (0.57) ALDH1A1
Methoxymethane SCHEMBL22118183 0.72
Ethane SCHEMBL25176936 0.71

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004083180-A1 NOVEL CRYSTALLINE FORMS OF LEVETIRACETAM HETERO DRUGS LIMITED (IN) 2004-09-30 WO claimed
WO-2024017266-A1 POLYMORPHIC FORM OF GLP-1R AGONIST, PREPARATION METHOD THEREFOR AND USE THEREOF 德睿智药(苏州)新药研发有限公司 2024-01-25 WO disclosed
CN-115385918-A Novel midazolam crystal form and preparation method thereof 成都硕德药业有限公司 2022-11-25 CN disclosed
US-8541419-B2 Isotopically enriched pyrimidin-5-yl acetic acid derivatives as CRTH2 antagonists ACTIMIS PHARMACEUTICALS, INC. (US) 2013-09-24 US disclosed
EP-2328876-B1 ISOTOPICALLY ENRICHED PYRIMIDIN-5-YL ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS ACTIMIS PHARMACEUTICALS INC (US) 2012-11-21 EP disclosed
US-20110172250-A1 ISOTOPICALLY ENRICHED PYRIMIDIN-5-YL ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS GB005, INC. 2011-07-14 US disclosed
EP-2328876-A1 ISOTOPICALLY ENRICHED PYRIMIDIN-5-YL ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS Actimis Pharmaceuticals, Inc., (US) 2011-06-08 EP disclosed
WO-2010027448-A1 ISOTOPICALLY ENRICHED PYRIMIDIN-5-YL ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS ACTIMIS PHARMACEUTICALS INC. (US) 2010-03-11 WO disclosed
US-20050143445-A1 Novel crystalline forms of levetiracetam HETERO DRUGS LIMITED (IN) 2005-06-30 US disclosed
WO-2004083180-A1 NOVEL CRYSTALLINE FORMS OF LEVETIRACETAM HETERO DRUGS LIMITED (IN) 2004-09-30 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 (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-20050143445-A1 Novel crystalline forms of levetiracetam EPM2A, MAPT, ATG4A ALDH1A1 2664/4885
US-20110172250-A1 ISOTOPICALLY ENRICHED PYRIMIDIN-5-YL ACETIC ACID DERIVATIVES AS CRTH2 ANTAGONISTS HRH2, HRH1, HRH4 ALDH1A1 599/4885

“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.