SCHEMBL7995843

SCHEMBL7995843

Cn1cc(CN2CCNC2=C[N+](=O)[O-])cn1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.60
CHRNA1 P02708 1/20 0.54
CHRNA3 P32297 1/20 0.54
CHRNA7 P36544 1/20 0.54
CHRNB2 P17787 3/20 0.36
CHRNA4 P43681 3/20 0.36
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 1/20 0.33
KCNH2 Q12809 2/20 0.33
GABRA1 P14867 1/20 0.32
GABRA5 P31644 1/20 0.32
GRIN1 Q05586 1/20 0.30
GRIN2B Q13224 1/20 0.30
DRD2 P14416 1/20 0.30
ERN1 O75460 1/20 0.30

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
SCHEMBL7995837 1.00 SMN1; SMN2 (0.60) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7992269 0.94 CHRNA1 (0.62) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7995527 0.81 SMN1; SMN2 (0.68) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7995529 0.81 SMN1; SMN2 (0.68) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7995469 0.80 SMN1; SMN2 (0.64) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7995471 0.80 SMN1; SMN2 (0.64) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL10738351 0.79 SMN1; SMN2 (0.69) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL10738344 0.79 SMN1; SMN2 (0.69) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7995718 0.78 SMN1; SMN2 (0.76) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2
SCHEMBL7993522 0.78 SMN1; SMN2 (0.68) SMN1; SMN2CHRNA1CHRNA3CHRNA7CHRNB2

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4742060-A 2-(NITROIMINO)- OR 2-(NITROMETHYLENE)-IMIDAZOLIDINES AS INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K. K. (JP) 1988-05-03 US claimed
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 EP claimed
US-6297374-B1 Nitroimino-nitromethylene—azole or-azine heterocyclic compounds, insecticidal compositions containing them, and insecticidal methods of using them NIHON BAYER AGROCHEM K.K. (JP) 2001-10-02 US disclosed
US-6022967-A 1-NITRO-2-CARBOXYVINYL- OR 1-NITRO-2-(DIMETHYLAMINO)VINYL-SUBSTITUTED IMIDAZOLIDINES OR TETRAHYDROPYRIMIDINES NIHON BAYER AGROCHEM K.K. (JP) 2000-02-08 US disclosed
US-5750704-A INSECTICIDES NIHON BAYER AGROCHEM K.K. (JP) 1998-05-12 US disclosed
US-5580889-A Insecticidal nitromethyl or niteoimino-heteromethyl-heterocyclics NIHON BAYER AGROCHEM K.K. (JP) 1996-12-03 US disclosed
US-5461167-A 2-chloro-5-chloromethyl thiazole; insecticide NIHON BAYER AGROCHEM K.K. (JP) 1995-10-24 US disclosed
US-5428032-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1995-06-27 US disclosed
US-5298507-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1994-03-29 US disclosed
US-5204360-A Insecticides NIHON BAYER AGROCHEM K.K. (JP) 1993-04-20 US disclosed
US-5001138-A Insecticides NIHON TOKUSHU NOYAKU SEIZO, K.K. (JP) 1991-03-19 US disclosed
US-4845106-A INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1989-07-04 US disclosed
US-4742060-A 2-(NITROIMINO)- OR 2-(NITROMETHYLENE)-IMIDAZOLIDINES AS INSECTICIDES NIHON TOKUSHU NOYAKU SEIZO K. K. (JP) 1988-05-03 US disclosed
EP-0192060-A1 Heterocyclic compounds NIHON BAYER AGROCHEM K.K. (JP) 1986-08-27 EP disclosed