SCHEMBL9070416

SCHEMBL9070416

O=[N+]([O-])C=C1NCC=CN1Cc1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.46
CHRNA4 P43681 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CHRNA1 P02708 1/20 0.43
CHRNA3 P32297 1/20 0.43
CHRNA7 P36544 1/20 0.43
ALDH1A1 P00352 4/20 0.37
GAA P10253 3/20 0.37
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
HSP90AA1 P07900 1/20 0.37
PAX8 Q06710 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
MAPT P10636 3/20 0.36
HTT P42858 3/20 0.36
MAPK1 P28482 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
KDM4E B2RXH2 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
Hydrochloric Acid SCHEMBL9326038 0.99 CHRNB2 (0.45) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL7993660 0.85 CHRNB2 (0.46) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
Hydrochloric Acid SCHEMBL10734635 0.84 CHRNB2 (0.46) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9070117 0.84 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL5197911 0.81 SMN1; SMN2 (0.67) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL5197909 0.81 SMN1; SMN2 (0.67) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL1019754 0.81 CHRNB2 (0.70) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9068992 0.81 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL10564708 0.81 CHRNB2 (0.52) CHRNB2CHRNA4SMN1; SMN2CHRNA1CHRNA3
SCHEMBL9070420 0.81 CHRNB2 (0.52) 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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
JP-62164605-A None JP disclosed
JP-62174001-A None JP disclosed
JP-62056407-A None JP disclosed
JP-62056408-A None JP disclosed
JP-62056404-A None JP disclosed
JP-62056405-A None JP disclosed
CN-1032182-C Stabilized agrochemical compositions NIHON TOKUSHU NOYAKU SEIZO KK (JP) 1996-07-03 CN disclosed
JP-S6256407-A INSECTICIDAL COMPOSITION FOR AGRICULTURE AND HORTICULTURE NIPPON TOKUSHU NOYAKU SEIZO KK 1987-03-12 JP disclosed
JP-S6256405-A INSECTICIDAL COMPOSITION FOR AGRICULTURE AND HORTICULTURE NIPPON TOKUSHU NOYAKU SEIZO KK 1987-03-12 JP disclosed
JP-S6256408-A INSECTIDICAL COMPOSITION FOR AGRICULTURE AND HORTICULTURE NIPPON TOKUSHU NOYAKU SEIZO KK 1987-03-12 JP disclosed
JP-S06256408-A 0001-01-01 JP disclosed
JP-S06256407-A 0001-01-01 JP disclosed
JP-S06256404-A 0001-01-01 JP disclosed
JP-S06256405-A 0001-01-01 JP disclosed