SCHEMBL7671788

SCHEMBL7671788

CCN(Cc1ccc(Cl)nc1)C(N)=C[N+](=O)[O-]

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.39
CHRNA4 P43681 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CHRNA1 P02708 1/20 0.37
CHRNA3 P32297 1/20 0.37
CHRNA7 P36544 1/20 0.37
CASP6 P55212 1/20 0.35

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
SCHEMBL7754488 1.00 CHRNB2 (0.39) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL7662053 0.91 CHRNB2 (0.38) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL10028752 0.86 ALDH1A1 (0.41) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL7660053 0.85 CHRNB2 (0.40) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL7752527 0.85 CHRNB2 (0.40) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL7657443 0.84 CHRNB2 (0.38) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
Nitenpyram SCHEMBL13448342 0.83 SMN1; SMN2 (0.40) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL888516 0.83 CHRNB2 (0.38) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
Nitenpyram SCHEMBL29388004 0.83 SMN1; SMN2 (0.40) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT
SCHEMBL888515 0.83 CHRNB2 (0.38) CHRNB2CHRNA4SMN1; SMN2ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407248-B1 INSECTICIDES, MITICIDES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-18 US disclosed
EP-0632957-B1 A method of killing noxious insects BAYER AGROCHEM KK (JP) 2001-01-17 EP disclosed
US-6124297-A COMBATTING INSECTS OR MITES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-09-26 US disclosed
US-5935981-A INSECTICIDAL/MITICIDAL ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-08-10 US disclosed
US-5882670-A MUSHROOM-CARRYING CRUSHED OR GROUND BROAD LEAVED TREE ATTRACTANT NIHON BAYER AGROCHEM K.K. (JP) 1999-03-16 US disclosed
US-5880142-A SYNERGISTIC MIXTURE OF CYFLUTHRIN AND SPECIFIC PERMEABLE INSECTICIDE NIHON BAYER AGROCHEM K.K. (JP) 1999-03-09 US disclosed
US-5849768-A α-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-12-15 US disclosed
EP-0648412-B1 Poisonous baits for controlling soil-inhabiting pests BAYER AGROCHEM KK (JP) 1998-12-02 EP disclosed
EP-0529680-B1 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-05-13 EP disclosed
US-5707640-A INSECTICIDES FOR SOILS NIHON BAYER AGROCHEM K.K. (JP) 1998-01-13 US disclosed
EP-0617890-A1 Synergistic insecticidal compositions NIHON BAYER AGROCHEM K.K. (JP) 1994-10-05 EP disclosed
EP-0302389-B1 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-22 EP disclosed
US-5214152-A Insecticides, miticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-05-25 US disclosed
US-5196442-A Chloropyridyl compounds NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1993-03-23 US disclosed
EP-0529680-A2 Intermediates, their production and their use for preparing alpha-unsaturated amines TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-03-03 EP disclosed
US-5175301-A Insecticide, miticide, pesticide TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-29 US disclosed
EP-0509559-A2 Alpha-unsaturated amines, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-21 EP disclosed
US-5087632-A Formicidal agent for combating termites NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1992-02-11 US disclosed
US-5084459-A Insecticides TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-01-28 US disclosed
EP-0302389-A2 Alpha-unsaturated amines, their production and use Takeda Chemical Industries, Ltd. (JP) 1989-02-08 EP disclosed