SCHEMBL175984

SCHEMBL175984

FC(F)(F)C(=NOCC1OCCO1)c1ccc(Cl)cc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 1/20 0.31
OXTR P30559 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
SCHEMBL5933972 1.00 NPC1 (0.33) NPC1RAB9ATDP1ALDH1A1LMNA
SCHEMBL23888 1.00 NPC1 (0.33) NPC1RAB9ATDP1ALDH1A1LMNA
SCHEMBL10736377 0.95 NPC1 (0.37) NPC1RAB9ATDP1ALDH1A1LMNA
SCHEMBL10976887 0.87 LMNA (0.36) LMNASMN1; SMN2
SCHEMBL10739600 0.87 LMNA (0.36) LMNASMN1; SMN2
SCHEMBL10739104 0.86 TDP1 (0.33) NPC1RAB9ATDP1ALDH1A1
SCHEMBL10737706 0.86 LMNA (0.33) LMNA
SCHEMBL10741450 0.82 LMNA (0.35) RAB9AALDH1A1LMNASMN1; SMN2
SCHEMBL10737260 0.81 NPC1 (0.33) NPC1RAB9A
SCHEMBL14572841 0.81 NPC1 (0.33) NPC1RAB9A

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 1062 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117546851-A Herbicidal compositions containing uracil compounds of carboxylate fragments and uses thereof 江苏中旗科技股份有限公司 2024-02-13 CN claimed
EP-2334175-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE 1,3 DIONE DERIVATIVES BAYER IP GMBH (DE) 2017-03-01 EP claimed
EP-2635550-B1 PHENYL-SUBSTITUTED BICYCLOOCTANE-1,3-DIONE-DERIVATIVES BAYER IP GMBH (DE) 2016-01-27 EP claimed
US-9204640-B2 2-acyloxy-pyrrolin-4-ones BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-08 US claimed
US-9198432-B2 1,2,4-triazolyl-substituted ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US claimed
EP-2681191-B1 2-ACYLOXY-PYRROLIN-4-ONES BAYER IP GMBH (DE) 2015-09-02 EP claimed
EP-2534147-B1 SPIROHETEROCYCLIC-SUBSTITUTED TETRAMIC ACID DERIVATIVES BAYER IP GMBH (DE) 2015-06-17 EP claimed
US-8946124-B2 Substituted 3-(biphenyl-3-yl)-8,8-difluoro-4-hydroxy-1-azaspiro[4.5]dec-3-en-2-ones for therapy and halogen-substituted spirocyclic ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-02-03 US claimed
EP-2210492-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-07-28 EP claimed
EP-2191716-A1 Herbicide safener combination Bayer CropScience AG (DE) 2010-06-02 EP claimed
EP-1130965-B1 COMBINATIONS OF HERBICIDES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2003-10-29 EP claimed
US-20030171220-A1 Combinations of herbicides and safeners BAYER INTELLECTUAL PROPERTY GMBH (DE) 2003-09-11 US claimed
US-20030078167-A1 Herbicides comprising benzoylcyclohexanediones and safeners BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2003-04-24 US claimed
WO-2002085120-A2 HERBICIDAL AGENT COMPRISING BENZOYLCYCLOHEXANEDIONES AND SAFENERS BAYER CROPSCIENCE GMBH (DE) 2002-10-31 WO claimed
EP-1206188-A1 HERBICIDE/SAFENER COMBINATION PRODUCTS Aventis CropScience GmbH (DE) 2002-05-22 EP claimed
EP-1130965-A1 COMBINATIONS OF HERBICIDES AND SAFENERS Aventis CropScience GmbH (DE) 2001-09-12 EP claimed
WO-2001008488-A1 HERBICIDE/SAFENER COMBINATION PRODUCTS AVENTIS CROPSCIENCE GMBH (DE) 2001-02-08 WO claimed
WO-2000030447-A1 COMBINATIONS OF HERBICIDES AND SAFENERS AVENTIS CROPSCIENCE GMBH (DE) 2000-06-02 WO claimed
US-4530716-A Plant safening agent CIBA-GEIGY CORPORATION (US) 1985-07-23 US claimed
EP-0089313-B1 OXIME ETHERS, PROCESS FOR THEIR PREPARATION, COMPOSITIONS CONTAINING THE OXIME ETHERS AND THEIR USE CIBA-GEIGY AG (CH) 1985-05-02 EP 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 (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-20030171220-A1 Combinations of herbicides and safeners DDT, CYP2B6, CYP2A6 NPC1 4504/4885RAB9A 3200/4885TDP1 1086/4885
US-20030078167-A1 Herbicides comprising benzoylcyclohexanediones and safeners DDT, HPD, HDHD5 NPC1 4730/4885RAB9A 4476/4885TDP1 1231/4885

“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.