SCHEMBL8548800

SCHEMBL8548800

COC(=S)NCC(OC)OC.NC(O)=S

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7450284 0.80 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL11460051 0.79
SCHEMBL13810444 0.73 ALDH1A1 (0.39) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL11174825 0.72 SMN1; SMN2 (0.43) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL15739721 0.71 MEN1 (0.34) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL3784058 0.71 KMT2A (0.41) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL2234056 0.71 ALDH1A1 (0.38) ALDH1A1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL10839227 0.71 MTNR1A (0.37) ALDH1A1
SCHEMBL10612612 0.70
SCHEMBL2236324 0.70

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
EP-0820994-A1 Tetrazolinones as herbicides and intermediates NIHON BAYER AGROCHEM K.K. (JP) 1998-01-28 EP disclosed