SCHEMBL10344444

SCHEMBL10344444

Cc1cc([N+](=O)[O-])c(N(CCCl)CCCl)c([N+](=O)[O-])c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.49
TSHR P16473 4/20 0.49
TDP1 Q9NUW8 3/20 0.49
MAPK1 P28482 2/20 0.49
GPR35 Q9HC97 1/20 0.47
MAPT P10636 4/20 0.41
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 3/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL11809594 0.94 CYP3A4 (0.58) CYP3A4TSHRTDP1MAPK1GPR35
SCHEMBL1876519 0.84 CYP3A4 (0.67) CYP3A4TSHRTDP1MAPK1GPR35
SCHEMBL13202978 0.82 ALDH1A1 (0.50) CYP3A4TSHRTDP1MAPK1GPR35
SCHEMBL11522696 0.80 CYP1A2 (0.41) CYP3A4TSHRTDP1MAPK1MAPT
SCHEMBL11880900 0.79 TSHR (0.51) CYP3A4TSHRMAPK1GPR35MAPT
SCHEMBL11762175 0.79 MAPK1 (0.73) CYP3A4TSHRTDP1MAPK1MAPT
SCHEMBL8633720 0.78 PARP1 (0.45) CYP3A4TSHRTDP1MAPK1MAPT
Fluchloralin SCHEMBL54746 0.76 CYP3A4 (0.86) CYP3A4TSHRTDP1MAPK1MAPT
Fluchloralin SCHEMBL8534586 0.76 CYP3A4 (0.86) CYP3A4TSHRTDP1MAPK1MAPT
SCHEMBL16577804 0.76 CYP3A4 (0.70) CYP3A4TSHRTDP1MAPK1GPR35

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 189 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
EP-3578542-B1 COMPOSITIONS HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-11-12 EP claimed
EP-3578543-B1 COMPOSITIONS COMPRISING MOLECULES HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-08-20 EP claimed
EP-3578541-B1 COMPOSITIONS COMPRISING MOLECULES HAVING PESTICIDAL UTILITY, AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-05-28 EP claimed
US-20250057161-A1 USE OF CYCLODEXTRINS AS AGROCHEMICAL DELIVERY SYSTEM ADAMA MAKHTESHIM LTD. (IL) 2025-02-20 US claimed
US-20230247988-A1 HERBICIDE COMBINATIONS UPL LTD (IN) 2023-08-10 US claimed
EP-4171230-A1 HERBICIDE COMBINATIONS UPL Limited (IN) 2023-05-03 EP claimed
EP-3247698-B1 CRYSTALLINE MODIFICATION OF PROPANIL UPL LTD (IN) 2022-10-19 EP claimed
EP-4046490-A1 AN IMPROVED HERBICIDAL FORMULATION UPL Limited (IN) 2022-08-24 EP claimed
US-11419336-B2 Herbicidal combination UPL LTD (IN) 2022-08-23 US claimed
EP-4007488-A1 TRIPLOID CANNABIS PLANTS AND METHODS FOR GENERATING SAME Canopy Growth Corporation (CA) 2022-06-08 EP claimed
US-4226789-A Removal of nitrosamines from denitroanilines by treatment with HCl ELI LILLY AND COMPANY (US) 1980-10-07 US claimed
US-4185035-A REMOVAL OF NITROSAMINES WITH PHOSPHORUS HALIDES ELI LILLY AND COMPANY (US) 1980-01-22 US claimed
US-4127610-A REMOVAL OF NITROSAMINES ELI LILLY AND COMPANY (US) 1978-11-28 US claimed
US-4077795-A 2,4-DINITROANILINE DERIVATIVES UNION CARBIDE CORPORATION (US) 1978-03-07 US claimed
WO-2026101910-A1 FUNGICIDAL FORMULATIONS CONTAINING ARYL AMIDINES AND METHODS OF USE CORTEVA AGRISCIENCE LLC (US) 2026-05-15 WO disclosed
US-12616203-B2 Use of 3-isoxazolidinones compounds as selective herbicides FMC CORPORATION (US) 2026-05-05 US disclosed
US-4011341-A HERBICIDES ELI LILLY AND COMPANY (US) 1977-03-08 US disclosed
US-3962307-A HERBICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-06-08 US disclosed
US-3726923-A PROCESS FOR THE MANUFACTURE OF N,N-DICHLOROALKYL-2,6-DINITRO-4-ALKYL ANILINE GLENFED FINANCIAL CORPORATION 1973-04-10 US 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 (4 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-11419336-B2 Herbicidal combination DDT, AADAC, DPP4 CYP3A4 296/4885TSHR 1254/4885TDP1 1931/4885
US-20230247988-A1 HERBICIDE COMBINATIONS DDT, NOTUM, FAAH2 CYP3A4 973/4885TSHR 2829/4885TDP1 1828/4885
US-12616203-B2 Use of 3-isoxazolidinones compounds as selective herbicides CNPY2, CRY2, DDT CYP3A4 318/4885TSHR 1156/4885TDP1 3691/4885
US-20250057161-A1 USE OF CYCLODEXTRINS AS AGROCHEMICAL DELIVERY SYSTEM DDT, GYS2, ACHE CYP3A4 175/4885TSHR 3713/4885TDP1 2654/4885

“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.