SCHEMBL7993750

SCHEMBL7993750

CCOCCc1ccc(C=O)cn1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 10/20 0.38
HPGD P15428 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.36
FDPS P14324 1/20 0.36
ALDH3A1 P30838 1/20 0.34
ALDH1A3 P47895 1/20 0.34
MYC P01106 4/20 0.34
KCNJ1 P48048 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP2A6 P11509 1/20 0.32

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
SCHEMBL20083690 0.83 ALDH1A1 (0.41) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL28009374 0.83 KDM4E (0.41) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL2172039 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL6919487 0.77 KDM4E (0.39) KDM4ESMN1; SMN2LMNAMYC
SCHEMBL4237400 0.77 GABRP (0.40) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL9446790 0.77 KDM4E (0.50) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL29417178 0.77 KDM4E (0.50) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL15136243 0.76 CYP4F2 (0.46) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL29952238 0.76 KDM4E (0.43) KDM4EALDH1A1HPGDSMN1; SMN2MAPT
SCHEMBL7999255 0.76 KDM4E (0.43) KDM4EALDH1A1HPGDSMN1; SMN2MAPT

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 11 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-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