SCHEMBL1019754

SCHEMBL1019754

O=[N+]([O-])C=C1NCC=CN1Cc1ccc(Cl)nc1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 5/20 0.70
CHRNA4 P43681 5/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
CHRNA1 P02708 2/20 0.66
CHRNA3 P32297 2/20 0.66
CHRNA7 P36544 2/20 0.66
ALDH1A1 P00352 2/20 0.52
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
CASP6 P55212 1/20 0.44
NPSR1 Q6W5P4 1/20 0.41

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
Hydrochloric Acid SCHEMBL10483913 0.99 CHRNB2 (0.69) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL7995341 0.87 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL10564708 0.86 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9070420 0.86 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9068992 0.86 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9070117 0.86 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9408704 0.86 CHRNB2 (0.49) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
Hydrochloric Acid SCHEMBL10483929 0.85 CHRNB2 (0.51) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9070366 0.84 CHRNB2 (0.49) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL10564722 0.84 CHRNB2 (0.49) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20010051643-A1 Agents for preserving technical materials against insects TSUBOI SHINICHI (JP) 2001-12-13 US claimed
CN-1032182-C Stabilized agrochemical compositions NIHON TOKUSHU NOYAKU SEIZO KK (JP) 1996-07-03 CN claimed
CN-1032185-C Stabilized agrochemical compositions NIHON TOKUSHU NOYAKU SEIZO KK (JP) 1996-07-03 CN claimed
EP-0431361-B1 Use of stabilizers for agrochemical compositions BAYER AGROCHEM KK (JP) 1994-02-23 EP claimed
EP-0431362-B1 Stabilized agrochemical compositions BAYER AGROCHEM KK (JP) 1993-11-03 EP claimed
EP-0511541-A1 Agents for preserving wood or composite-wood materials against insects NIHON BAYER AGROCHEM K.K. (JP) 1992-11-04 EP claimed
EP-0431361-A1 Use of stabilizers for agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP claimed
EP-0431362-A1 Stabilized agrochemical compositions NIHON BAYER AGROCHEM K.K. (JP) 1991-06-12 EP claimed
US-4774247-A Nitromethylene derivative insecticides NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-09-27 US claimed
JP-5032505-A None JP disclosed
JP-62048681-A None JP disclosed
JP-60218386-A None JP disclosed
US-12207644-B2 Insect barrier ENGINEERED MATERIALS, INC. (US) 2025-01-28 US disclosed
US-11291199-B2 Insect barrier ENGINEERED MATERIALS, INC. (US) 2022-04-05 US disclosed
US-4876263-A Pesticidal nitro-substituted heterocyclic compounds NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-10-24 US disclosed
US-4780457-A SYNERGISTIC NITROMETHYLENE DERIVATIVE AND CHLORPYRIFOS DERIVATIVE NIHON TOKUSHI NOYAKU SEIZO K.K. (JP) 1988-10-25 US disclosed
US-4731385-A NITROMETHYLENE DERIVATIVE NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-03-15 US disclosed
US-4725589-A SYNERGISTIC BLEND OF NITROMETHYLENE AND ORGANOPHOSPHATE ESTER NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1988-02-16 US disclosed
JP-S6248681-A PRODUCTION OF NITROMETHYLENE DERIVATIVE NIPPON TOKUSHU NOYAKU SEIZO KK 1987-03-03 JP disclosed
JP-S60218386-A NITROMETHYLENE DERIVATIVE, ITS INTERMEDIATE, PREPARATION THEREOF AND INSECTICIDE NIPPON TOKUSHU NOYAKU SEIZO KK 1985-11-01 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-20010051643-A1 Agents for preserving technical materials against insects GPX1, FEN1, POT1 CHRNB2 4731/4885CHRNA4 4778/4885SMN1; SMN2 1051/4885

“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.