SCHEMBL1372401

SCHEMBL1372401

O=C(O)C(F)(F)C(F)F.[NaH]

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.39
ALDH1A1 P00352 2/20 0.33
ODC1 P11926 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
THRB P10828 1/20 0.32
TP53 P04637 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL128482 0.97
SCHEMBL28216786 0.94 PKM (0.39) PKMALDH1A1ODC1L3MBTL1KDM4E
SCHEMBL9069392 0.94 PKM (0.39) PKMALDH1A1ODC1L3MBTL1KDM4E
SCHEMBL28804484 0.94 PKM (0.39) PKMALDH1A1ODC1L3MBTL1KDM4E
Hydrochloric Acid SCHEMBL16600366 0.94 PKM (0.39) PKMALDH1A1ODC1L3MBTL1KDM4E
Ammonia Solution, Strong SCHEMBL29007565 0.94 PKM (0.39) PKMALDH1A1ODC1L3MBTL1KDM4E
Benzene SCHEMBL29009877 0.91 PKM (0.38) PKMALDH1A1ODC1L3MBTL1KDM4E
Water SCHEMBL28038398 0.91 PKM (0.38) PKMALDH1A1ODC1L3MBTL1KDM4E
SCHEMBL29694572 0.84 TP53 (0.35) PKMTP53
SCHEMBL8441830 0.84 ALDH1A1 (0.44) PKMALDH1A1L3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-54086619-A None JP disclosed
EP-4602036-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES Bayer Aktiengesellschaft (DE) 2025-08-20 EP disclosed
WO-2025103929-A1 SUBSTITUTED N-BENZOIC ACID URACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2025-05-22 WO disclosed
WO-2025103927-A1 SUBSTITUTED OXYIMINOMETHYLPHENYL URACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2025-05-22 WO disclosed
WO-2025103939-A1 SULFONIMIDOYL BENZAMIDES WITH HERBICIDAL ACTION BAYER AKTIENGESELLSCHAFT (DE) 2025-05-22 WO disclosed
CN-118159536-A Substituted 1,2, 4-thiadiazolyl nicotinamide, salts or N-oxides thereof and their use as herbicidal active substances 拜耳公司 2024-06-07 CN disclosed
WO-2024104954-A1 SUBSTITUTED CYCLOALKYLOXYPHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-05-23 WO disclosed
WO-2024078871-A1 1-PYRIDYL-5-PHENYLPYRAZOLYL-3-OXY- AND -3-THIOALKYL ACIDS AND DERIVATIVES AND THEIR USE FOR CONTROLLING UNDESIRED PLANT GROWTH BAYER AKTIENGESELLSCHAFT (DE) 2024-04-18 WO disclosed
WO-2024078906-A1 SUBSTITUTED N-PHENYLURACILS AND SALTS THEREOF, AND USE THEREOF AS HERBICIDAL ACTIVE SUBSTANCES BAYER AKTIENGESELLSCHAFT (DE) 2024-04-18 WO disclosed
CN-117794928-A Substituted 1,2, 4-thiadiazolyl nicotinamide, salts or N-oxides thereof and their use as herbicidal active substances 拜耳公司 2024-03-29 CN disclosed
CN-113873887-A Herbicidal composition 石原产业株式会社 2021-12-31 CN disclosed
US-20210307318-A1 Process for Preparation of Agrichemical Broadcast Granules GRANULAR PRODUCTS ASSETS PTY LTD (AU) 2021-10-07 US disclosed
CN-112279748-A Preparation method of 1,1,2,2-tetrafluoroethane 浙江巨化技术中心有限公司 2021-01-29 CN disclosed
CN-211886777-U Multistage electrocatalytic membrane reactor 天津工业大学 2020-11-10 CN disclosed
WO-2020037363-A1 PROCESS FOR PREPARATION OF AGRICHEMICAL BROADCAST GRANULES GRANULAR PRODUCTS ASSETS PTY LTD (AU) 2020-02-27 WO disclosed
EP-2394995-B1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES KUMIAI CHEMICAL INDUSTRY CO (JP) 2014-01-15 EP disclosed
US-8334236-B2 Ring-fused 2-pyridone derivatives and herbicides KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2012-12-18 US disclosed
EP-2394995-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES Kumiai Chemical Industry CO., LTD. (JP) 2011-12-14 EP disclosed
US-20110287937-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2011-11-24 US disclosed
JP-S5486619-A HERBOCIDE FOR FOREST HODOGAYA CHEM CO LTD 1979-07-10 JP 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 (1 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-20110287937-A1 RING-FUSED 2-PYRIDONE DERIVATIVES AND HERBICIDES CBR3, CBR1, CHRM1 PKM 710/4885ALDH1A1 623/4885ODC1 592/4885

“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.