Sugi Predict

Sugi Predict / Compounds / SCHEMBL9936626

SCHEMBL9936626

SCHEMBL9936626

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

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ RECQL P46063 1/20 0.38
▸ KMT2A Q03164 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32

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
SCHEMBL7099123 0.96 TSHR (0.44) TSHRTDP1KDM4EALDH1A1RECQL
SCHEMBL7099055 0.96 TSHR (0.44) TSHRTDP1KDM4EALDH1A1RECQL
SCHEMBL28985 0.96 TSHR (0.44) TSHRTDP1KDM4EALDH1A1RECQL
SCHEMBL8908158 0.96 TSHR (0.44) TSHRTDP1KDM4EALDH1A1RECQL
Fluoride SCHEMBL6864685 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL
Hydrochloric Acid SCHEMBL3003894 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL
SCHEMBL11661714 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL
Ammonia Solution, Strong SCHEMBL22773015 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL
Hydrogen Peroxide SCHEMBL28243254 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL
Bromide SCHEMBL9462752 0.93 TSHR (0.41) TSHRTDP1KDM4EALDH1A1RECQL

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 556 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 TSHR 4706/4885TDP1 2536/4885KDM4E 2106/4885
US-10932467-B2 Herbicidal mixtures DDT, PRDX5, DHX35 TSHR 4489/4885TDP1 763/4885KDM4E 111/4885
US-11191265-B2 Method of reducing crop damage DDT, GAP43, GSS TSHR 3501/4885TDP1 240/4885KDM4E 3052/4885
US-20210137117-A1 HERBICIDAL MIXTURES DDT, MTX2, ATL3 TSHR 4563/4885TDP1 2188/4885KDM4E 1040/4885
US-20190008153-A1 New uses of 2-(2,4-dichlorophenyl)methyl-4,4-dimethyl-3-isoxazolidone as foliar herbicide DDT, DAO, CYP4X1 TSHR 1868/4885TDP1 2290/4885KDM4E 158/4885
US-20210227824-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS TSHR 3501/4885TDP1 240/4885KDM4E 3052/4885
US-11219209-B2 Method of reducing crop damage DDT, GAP43, GSS TSHR 3501/4885TDP1 240/4885KDM4E 3052/4885
US-20210127667-A1 METHOD OF REDUCING CROP DAMAGE DDT, GAP43, GSS TSHR 3501/4885TDP1 240/4885KDM4E 3052/4885

“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.