SCHEMBL28017189

SCHEMBL28017189

NC(=S)NNN1C=NCC1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL27849535 0.80
Carbon Dioxide SCHEMBL28199984 0.74
SCHEMBL8340941 0.72 ALDH1A1 (0.37) ALDH1A1HPGDHSD17B10
Pyridine SCHEMBL28030545 0.70
SCHEMBL322046 0.69
Bromide SCHEMBL7086983 0.66
SCHEMBL28218873 0.64
Thiourea SCHEMBL28398231 0.63
SCHEMBL28097892 0.62
SCHEMBL10753447 0.61 ALDH1A1 (0.43) ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104775123-A Preparation method of thiosemicarbazide imidazoline derivative corrosion inhibitor CHENGDU SHIDALIDUN TECHNOLOGY CO LTD 2015-07-15 CN disclosed
CN-104775123-A Preparation method of thiosemicarbazide imidazoline derivative corrosion inhibitor CHENGDU SHIDALIDUN TECHNOLOGY CO LTD 2015-07-15 CN disclosed