SCHEMBL7998784

SCHEMBL7998784

CCCN(C)C=O.COC(C)OC

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 1/20 0.31
ADH1A P07327 1/20 0.31
USP2 O75604 1/20 0.30
ALOX15 P16050 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
SCHEMBL1975022 0.83 USP2 (0.32) USP2ALOX15
SCHEMBL41853 0.82
SCHEMBL6653799 0.81 ADH1A (0.31) ADH1CADH1A
Hydrochloric Acid SCHEMBL8309133 0.79
Dimethylformamide SCHEMBL2184966 0.74 TSHR (0.53)
Dimethylformamide SCHEMBL124684 0.74 TSHR (0.53)
SCHEMBL2034737 0.73 ADH1C (0.32) ADH1CADH1A
Dimethylformamide SCHEMBL3928720 0.72 TSHR (0.39)
SCHEMBL11699019 0.72 ADH1C (0.38) ADH1CADH1A
SCHEMBL2035531 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001017977-A1 1,3,5-TRIAZINES AS HERBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2001-03-15 WO disclosed