SCHEMBL7995754

SCHEMBL7995754

NCCNCc1cnc(Cl)nn1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.32
MAOB P27338 1/20 0.32
CHRM2 P08172 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
CA12 O43570 2/20 0.31
CA6 P23280 2/20 0.31
CA7 P43166 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 2/20 0.31
CA5B Q9Y2D0 2/20 0.31
MEN1 O00255 1/20 0.31
RECQL P46063 1/20 0.31
KMT2A Q03164 1/20 0.31
MC4R P32245 1/20 0.31
MC5R P33032 1/20 0.31
LMNA P02545 2/20 0.30
TDP1 Q9NUW8 2/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA3 P07451 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
SCHEMBL7992424 0.76 SIRT6 (0.36) TLR7MAOBCHRM2SIGMAR1CA12
SCHEMBL7995502 0.76 MC4R (0.41) MAOBCHRM2SIGMAR1CA12CA6
SCHEMBL7999337 0.73 ALDH1A1 (0.42) CHRM2SIGMAR1CA12CA6CA7
SCHEMBL10483930 0.71 MAOB (0.49) MAOBCHRM2MEN1KMT2A
SCHEMBL7982061 0.71 CA12 (0.38) SIGMAR1CA12CA6CA7CA9
SCHEMBL7981616 0.70 FERMT2 (0.38) CHRM2SIGMAR1MC4RMC5R
SCHEMBL7992418 0.69 MC4R (0.44) MAOBCHRM2CA12CA6CA7
SCHEMBL5833062 0.69 CYP1A2 (0.38) TLR7MEN1KMT2ALMNAALOX15
SCHEMBL7995943 0.68 CYP1A2 (0.36) CHRM2SIGMAR1CA12CA6CA7
Ethylenediamine SCHEMBL5884629 0.68 TLR7 (0.39) TLR7MEN1KMT2ALMNAALOX15

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