SCHEMBL18677607

SCHEMBL18677607

COC(CC(=N)Br)NC=O

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 1/20 0.30
ADH1C P00326 1/20 0.30
ADH1A P07327 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
SCHEMBL7211769 0.70
SCHEMBL730294 0.69
SCHEMBL11873574 0.69
SCHEMBL1920404 0.67 ADH1B (0.31) ADH1BADH1CADH1A
SCHEMBL7519665 0.65 ADH1B (0.39) ADH1BADH1CADH1A
SCHEMBL1919591 0.64
SCHEMBL1919900 0.63 ADH1B (0.32) ADH1BADH1CADH1A
SCHEMBL8675118 0.59 SMPD1 (0.36) ADH1BADH1CADH1A
SCHEMBL9032142 0.59
SCHEMBL9099801 0.57 ADH1B (0.39) ADH1BADH1CADH1A

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-2017050921-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDES AND ANALOGUES AS INSECTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2017-03-30 WO disclosed