SCHEMBL164208

SCHEMBL164208

CCC(C)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1OC(C)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.76
KMT2A Q03164 6/20 0.41
MEN1 O00255 5/20 0.41
POLB P06746 4/20 0.41
LMNA P02545 3/20 0.41
ALDH1A1 P00352 6/20 0.40
GPR35 Q9HC97 4/20 0.40
MAPT P10636 6/20 0.39
HPGD P15428 4/20 0.39
MAPK1 P28482 3/20 0.39
KDM4E B2RXH2 1/20 0.39
TTR P02766 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
RECQL P46063 1/20 0.39
PMP22 Q01453 1/20 0.39
HIF1A Q16665 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL29391643 1.00 TDP1 (0.76) TDP1KMT2AMEN1POLBLMNA
SCHEMBL27323014 0.90 TDP1 (0.76) TDP1KMT2AMEN1POLBLMNA
SCHEMBL17764795 0.90 TDP1 (0.76) TDP1KMT2AMEN1POLBLMNA
SCHEMBL9420507 0.88 TDP1 (0.69) TDP1KMT2AMEN1POLBLMNA
SCHEMBL27479445 0.88 TDP1 (0.69) TDP1KMT2AMEN1POLBLMNA
SCHEMBL988632 0.87 TDP1 (0.68) TDP1KMT2AMEN1POLBLMNA
Binapacryl SCHEMBL29609584 0.87 TDP1 (0.68) TDP1KMT2AMEN1POLBLMNA
SCHEMBL988631 0.87 TDP1 (0.68) TDP1KMT2AMEN1POLBLMNA
Binapacryl SCHEMBL54301 0.87 TDP1 (0.68) TDP1KMT2AMEN1POLBLMNA
SCHEMBL29413979 0.86 TDP1 (1.00) TDP1KMT2AMEN1POLBLMNA

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 1395 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3060043-B1 PESTICIDAL COMPOSITIONS AND RELATED METHODS CORTEVA AGRISCIENCE LLC (US) 2025-11-26 EP claimed
US-20230000079-A1 COMBINATION COMPRISING A TRIKETONE HERBICIDE AND A DIPHENYLETHER HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION Generic Crop Science LLC (US) 2023-01-05 US claimed
US-20210378241-A1 COMBINATION COMPRISING A BENZAMIDE HERBICIDE AND A PYRIDINE CARBOXYLIC ACID HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION Generic Crop Science LLC (US) 2021-12-09 US claimed
EP-3174865-B1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2020-12-09 EP claimed
US-20200236925-A1 METHODS AND FORMULATIONS FOR PREVENTING DOWNWARD MIGRATION OF AGRICULTURAL MATERIALS DISCOVERY PURCHASER CORPORATION 2020-07-30 US claimed
WO-2020154349-A1 METHODS AND FORMULATIONS FOR PREVENTING DOWNWARD MIGRATION OF AGRICULTURAL MATERIALS BAYER CROPSCIENCE LP (US) 2020-07-30 WO claimed
US-RE48057-E1 Pesticidal compositions and related methods DOW AGROSCIENCES LLC (US) 2020-06-23 US claimed
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2020-02-20 US claimed
EP-3145312-B1 PESTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2019-11-20 EP claimed
EP-3160943-B1 MOLECULES HAVING CERTAIN PESTICIDAL UTILITIES, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-09-18 EP claimed
WO-2000062792-A2 COMPOSITIONS AND METHODS FOR CONTROLLING PESTS INSECT BIOTECHNOLOGY, INC. (US) 2000-10-26 WO claimed
EP-0986303-A1 HERBICIDAL COMPOSITIONS ISAGRO RICERCA S.r.l. (IT) 2000-03-22 EP claimed
WO-1998054967-A1 HERBICIDAL COMPOSITIONS ISAGRO RICERCA S.R.L. (IT) 1998-12-10 WO claimed
CN-1200652-A Herbicidal mixtures with synergistic activity BASF AG (DE) 1998-12-02 CN claimed
EP-0261492-B1 Suspoemulsions of plant-protecting agents HOECHST SCHERING AGREVO GMBH (DE) 1995-12-06 EP claimed
EP-0257845-B1 METHOD OF PRODUCING VARIEGATED PLANTS Taguchi, Masayasu (JP) 1991-10-16 EP claimed
EP-0247721-A1 Alditol derivative esters of triclopyr , processes for their preparation and herbicidal compositions containing them THE DOW CHEMICAL COMPANY (US) 1987-12-02 EP claimed
EP-0117999-B1 PLANT PROTECTION AGENTS IN THE FORM OF DISPERSION MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1986-10-15 EP claimed
US-4594096-A Aqueous suspension of pesticide HOECHST AKTIENGESELLSCHAFT (DE) 1986-06-10 US claimed
EP-0005917-A1 Herbicidal method and mixtures of herbicidal heterocyclic compounds FISONS plc (GB) 1979-12-12 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 (3 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-20230000079-A1 COMBINATION COMPRISING A TRIKETONE HERBICIDE AND A DIPHENYLETHER HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION DDT, TDO2, DNTT TDP1 289/4885KMT2A 1602/4885MEN1 4740/4885
US-20210378241-A1 COMBINATION COMPRISING A BENZAMIDE HERBICIDE AND A PYRIDINE CARBOXYLIC ACID HERBICIDE, AND A METHOD FOR MAKING AND USING THE COMBINATION DDT, GAP43, PDHA2 TDP1 750/4885KMT2A 2371/4885MEN1 4629/4885
US-20200055846-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, DDT, PTMS TDP1 2067/4885KMT2A 3565/4885MEN1 2610/4885

“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.