SCHEMBL7999250

SCHEMBL7999250

Clc1ccc(C2NCCS2)cn1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ALDH1A1 P00352 3/20 0.49
CHRNB2 P17787 8/20 0.45
CHRNA4 P43681 8/20 0.45
CHRNB4 P30926 5/20 0.45
CHRNA3 P32297 5/20 0.45
CHRNA7 P36544 4/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CHRNA1 P02708 1/20 0.45
CHRNG P07510 1/20 0.45
CHRNB1 P11230 1/20 0.45
HPGD P15428 1/20 0.45
CHRND Q07001 1/20 0.45
CHRNA2 Q15822 1/20 0.45

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
SCHEMBL27585166 0.73 CHRNB2 (0.51) TDP1ALDH1A1CHRNB2CHRNA4CHRNB4
SCHEMBL8923934 0.71 CHRNB2 (0.56) MAPTTDP1SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL2082827 0.69 MAPT (1.00) MAPTTDP1SMN1; SMN2ALDH1A1
SCHEMBL4153725 0.69 MAPT (0.61) MAPTTDP1SMN1; SMN2ALDH1A1CHRNB2
SCHEMBL7193197 0.69 CHRNB2 (0.53) ALDH1A1CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL31637165 0.69 CHRNB2 (0.53) ALDH1A1CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL4655299 0.69 MAPT (0.66) MAPTTDP1SMN1; SMN2ALDH1A1HPGD
SCHEMBL10792119 0.68 MAPT (0.50) MAPTTDP1SMN1; SMN2ALDH1A1MEN1
SCHEMBL20401781 0.67 CHRNB2 (0.57) TDP1ALDH1A1CHRNB2CHRNA4CHRNB4
SCHEMBL25330905 0.67 CHRNB2 (0.49) TDP1ALDH1A1CHRNB2CHRNA4CHRNB4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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