SCHEMBL8562158

SCHEMBL8562158

C=CS(=O)(=O)CCOCCNC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA12 O43570 2/20 0.31
CA1 P00915 2/20 0.31
CA4 P22748 2/20 0.31
CA9 Q16790 2/20 0.31
CA14 Q9ULX7 2/20 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
SCHEMBL10351801 0.86 FBP1 (0.35) CA2SMN1; SMN2MEN1KMT2ACA12
SCHEMBL6124935 0.83 MAPK1 (0.36) CA2SMN1; SMN2MEN1KMT2A
SCHEMBL8779998 0.78
SCHEMBL8958454 0.78 CA2 (0.50) CA2SMN1; SMN2MEN1KMT2ACA12
SCHEMBL259146 0.78 ALDH1A1 (0.32) CA2CA9
SCHEMBL8958306 0.75 CA2 (0.53) CA2SMN1; SMN2MEN1KMT2ACA12
SCHEMBL4357945 0.75 ALDH1A1 (0.36) CA2CA9
SCHEMBL8958384 0.75 CA2 (0.53) CA2SMN1; SMN2MEN1KMT2ACA12
SCHEMBL8958158 0.75 CA2 (0.53) CA2SMN1; SMN2MEN1KMT2ACA12
SCHEMBL8958443 0.75 CA2 (0.53) CA2SMN1; SMN2MEN1KMT2ACA12

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
US-5723211-A PSEUDO-BOEHEMITE EASTMAN KODAK COMPANY (US) 1998-03-03 US disclosed