SCHEMBL9936627

SCHEMBL9936627

CC(C)(O)N(C(C)(C)O)C(C)(C)O.[KH]

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
THRB P10828 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
SCHEMBL28986 0.95 ALDH1A1 (0.33) ALDH1A1THRB
SCHEMBL27981952 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Hydrochloric Acid SCHEMBL28028110 0.91 ALDH1A1 (0.31) ALDH1A1THRB
SCHEMBL28394929 0.91 ALDH1A1 (0.31) ALDH1A1THRB
SCHEMBL28597013 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Fluoride SCHEMBL6864688 0.91 ALDH1A1 (0.31) ALDH1A1THRB
Bromide SCHEMBL9462755 0.91 ALDH1A1 (0.31) ALDH1A1THRB
SCHEMBL28584995 0.91 ALDH1A1 (0.31) ALDH1A1THRB
SCHEMBL925734 0.78
SCHEMBL15452998 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3599857-B1 HERBICIDAL MIXTURES BAYER AG (DE) 2023-08-23 EP claimed
US-11219209-B2 Method of reducing crop damage BAYER AKTIENGESELLSCHAFT (DE) 2022-01-11 US claimed
US-11191265-B2 Method of reducing crop damage BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2021-12-07 US claimed
US-20210289781-A1 HERBICIDAL MIXTURES BAYER AKTIENGESELLSCHAFT (DE) 2021-09-23 US claimed
US-20210227824-A1 METHOD OF REDUCING CROP DAMAGE BAYER AKTIENGESELLSCHAFT (DE) 2021-07-29 US claimed
US-20210137117-A1 HERBICIDAL MIXTURES FMC CORPORATION 2021-05-13 US claimed
US-20210127667-A1 METHOD OF REDUCING CROP DAMAGE BAYER AKTIENGESELLSCHAFT (DE) 2021-05-06 US claimed
US-10932467-B2 Herbicidal mixtures BAYER AKTIENGESELLSCHAFT (DE) 2021-03-02 US claimed
EP-3758484-A1 METHOD OF REDUCING CROP DAMAGE Bayer Aktiengesellschaft (DE) 2021-01-06 EP claimed
EP-3758483-A1 METHOD OF REDUCING CROP DAMAGE Bayer Aktiengesellschaft (DE) 2021-01-06 EP claimed
EP-3506747-A2 METHOD OF REDUCING CROP DAMAGE Bayer CropScience Aktiengesellschaft (DE) 2019-07-10 EP claimed
US-20190008153-A1 New uses of 2-(2,4-dichlorophenyl)methyl-4,4-dimethyl-3-isoxazolidone as foliar herbicide FMC CORPORATION 2019-01-10 US claimed
WO-2018172442-A1 HERBICIDAL MIXTURES BAYER AKTIENGESELLSCHAFT (DE) 2018-09-27 WO claimed
WO-2018172325-A1 HERBICIDAL MIXTURES CONTAINING 2-[2,4-DICHLOROPHENYL)METHYL]4,4-DIMETHYL-3-ISOXAZOLIDINONE, PYROXASULFONE AND MEFENPYR-DIETHYL BAYER AKTIENGESELLSCHAFT (DE) 2018-09-27 WO claimed
WO-2018114796-A1 HERBICIDE COMBINATIONS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-06-28 WO claimed
EP-3338551-A1 HERBICIDE COMBINATIONS Bayer CropScience Aktiengesellschaft (DE) 2018-06-27 EP claimed
EP-3331363-A1 NEW USES OF 2-(2,4-DICHLOROPHENYL)METHYL-4,4-DIMETHYL-3-ISOXAZOLIDONE AS FOLIAR HERBICIDE Bayer CropScience Aktiengesellschaft (DE) 2018-06-13 EP claimed
WO-2018041762-A2 METHOD OF REDUCING CROP DAMAGE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2018-03-08 WO claimed
WO-2017025418-A1 NEW USES OF 2-(2,4-DICHLOROPHENYL)METHYL-4,4-DIMETHYL-3-ISOXAZOLIDONE AS FOLIAR HERBICIDE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2017-02-16 WO claimed
US-20140310835-A1 SOYBEAN EVENT SYHT04R AND COMPOSITIONS AND METHODS FOR DETECTION THEREOF SYNGENTA PARTICIPATIONS AG (CH) 2014-10-16 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 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-20210289781-A1 HERBICIDAL MIXTURES ATL3, DDT, CLSPN ALDH1A1 676/4885THRB 4691/4885
US-10932467-B2 Herbicidal mixtures DDT, PRDX5, DHX35 ALDH1A1 1609/4885THRB 4576/4885
US-11191265-B2 Method of reducing crop damage DDT, GAP43, GSS ALDH1A1 1990/4885THRB 3911/4885
US-20210137117-A1 HERBICIDAL MIXTURES DDT, MTX2, ATL3 ALDH1A1 1071/4885THRB 4513/4885
US-20190008153-A1 New uses of 2-(2,4-dichlorophenyl)methyl-4,4-dimethyl-3-isoxazolidone as foliar herbicide DDT, DAO, CYP4X1 ALDH1A1 514/4885THRB 2850/4885
US-20210227824-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS ALDH1A1 1990/4885THRB 3911/4885
US-11219209-B2 Method of reducing crop damage DDT, GAP43, GSS ALDH1A1 1990/4885THRB 3911/4885
US-20210127667-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS ALDH1A1 1990/4885THRB 3911/4885

“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.