SCHEMBL162999

SCHEMBL162999

O=[N+]([O-])c1cc2ccccc2c(Cl)c1[N+](=O)[O-]

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.59
CASP6 P55212 1/20 0.56
TSHR P16473 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
ALDH1A1 P00352 4/20 0.50
HPRT1 P00492 1/20 0.47
MAPT P10636 3/20 0.45
NPC1 O15118 2/20 0.45
LMNA P02545 2/20 0.45
RAB9A P51151 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
TLR9 Q9NR96 2/20 0.45
XBP1 P17861 1/20 0.45
PAX8 Q06710 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
CDK2 P24941 2/20 0.43
MITF O75030 1/20 0.42
AGTR1 P30556 1/20 0.42
HTT P42858 1/20 0.42

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
Biphenyl SCHEMBL746706 0.94 CYP3A4 (0.53) CYP3A4CASP6TSHRTDP1ALDH1A1
Chloroneb SCHEMBL4396425 0.86 LMNA (0.46) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL7827176 0.86 CASP6 (0.59) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL188171 0.84 CYP3A4 (0.71) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL7912363 0.83 CYP3A4 (0.59) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL4369022 0.79 CASP6 (0.75) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL9345317 0.77 CYP3A4 (0.56) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL5071421 0.77 ALDH1A1 (0.60) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL8622947 0.76 HPRT1 (0.76) CYP3A4CASP6TSHRTDP1ALDH1A1
SCHEMBL11416804 0.76 ALDH1A1 (0.56) CYP3A4CASP6TSHRTDP1ALDH1A1

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 1510 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-20240188569-A1 NEW YEAST STRAIN AND ITS USES FOR THE CONTROL OF PHYTOPATHOGENS AGROVENTURES LLC (US) 2024-06-13 US claimed
US-20240138408-A1 COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF SHANGDONG KANGIAO BIO-TECHNOLOGY CO., LTD (CN) 2024-05-02 US claimed
EP-4323496-A1 NEW YEAST STRAIN AND ITS USES FOR THE CONTROL OF PHYTOPATHOGENS AGROVENTURES S.R.L. (IT) 2024-02-21 EP claimed
CN-117203324-A Novel yeast strains and their use in controlling plant pathogens 爱农创投有限公司 2023-12-08 CN claimed
EP-3614845-B1 FUNGICIDAL COMBINATIONS UPL LTD (IN) 2023-11-01 EP claimed
CN-116940236-A Composition containing benzylamine acaricide and application thereof 山东康乔生物科技有限公司 2023-10-24 CN claimed
US-20120195974-A1 CONTROLLING MEALYBUGS DOW AGROSCIENCES LLC (US) 2012-08-02 US claimed
WO-2012103393-A2 CONTROLLING MEALYBUGS DOW AGROSCIENCES LLC (US) 2012-08-02 WO claimed
WO-2012061290-A2 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 WO claimed
WO-2012061288-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-10 WO claimed
US-20120110701-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2012-05-03 US claimed
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto CORTEVA AGRISCIENCE LLC 2012-05-03 US claimed
CN-102143841-A Gelatinous elastomer compositions SILIPOS INC 2011-08-03 CN claimed
EP-2323844-A1 GELATINOUS ELASTOMER COMPOSITIONS Silipos Inc. (US) 2011-05-25 EP claimed
WO-2010030824-A1 GELATINOUS ELASTOMER COMPOSITIONS SILIPOS, INC. (US) 2010-03-18 WO claimed
US-20100063008-A1 GELATINOUS ELASTOMER COMPOSITIONS SILIPOS, INC. (US) 2010-03-11 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 (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-20120110701-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO ACHE, AGPS, DDT CYP3A4 91/4885CASP6 129/4885TSHR 1004/4885
US-20240138408-A1 COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF BCHE, AAAS, BROX CYP3A4 1542/4885CASP6 1065/4885TSHR 4757/4885
US-20120110702-A1 Pesticidal Compositions and Processes Related Thereto ACHE, DDT, PTMS CYP3A4 129/4885CASP6 128/4885TSHR 1156/4885

“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.