SCHEMBL5033242

SCHEMBL5033242

O=P(O)(S)C#CP(=O)(O)S

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.36
TYMS P04818 1/20 0.35
SLC34A1 Q06495 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KDM4E B2RXH2 1/20 0.31
MMP2 P08253 1/20 0.31
THRB P10828 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
FDPS P14324 1/20 0.31
BLM P54132 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CFTR P13569 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
SCHEMBL11784040 0.75
SCHEMBL5028935 0.75
SCHEMBL25522 0.75
SCHEMBL2407345 0.75 CA2 (0.46) CA2TYMSSLC34A1KDM4EMMP2
SCHEMBL7820 0.75
SCHEMBL15467677 0.70
SCHEMBL10527922 0.70 CA2 (0.42) CA2TYMSSLC34A1KDM4EMMP2
Hydrogen Sulfide SCHEMBL8062675 0.70 CA2 (0.42) CA2TYMSSLC34A1KDM4EMMP2
Hydrogen Peroxide SCHEMBL7056368 0.70 CA2 (0.42) CA2TYMSSLC34A1KDM4EMMP2
SCHEMBL21044698 0.70 CA2 (0.42) CA2TYMSSLC34A1KDM4EMMP2

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-2008055963-A1 NOVEL METHOD FOR PRODUCING ORGANIC PHOSPHORUS COMPOUNDS, PHOSPHORUS COMPOUNDS PRODUCED USING SAID METHOD, THE METAL COMPLEXES OF SAID COMPOUNDS, AND USE OF SAME Rheinisch-Westfälische Technische Hochschule Aachen (DE) 2008-05-15 WO disclosed