SCHEMBL9446017

SCHEMBL9446017

C=CP(=O)(O)O.C=CP(=O)(O)O.C=CP(=O)(O)O.C=CP(=O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
CA2 P00918 1/20 0.36
SLC34A1 Q06495 1/20 0.33
PGK1 P00558 1/20 0.32
PGK2 P07205 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
LMNA P02545 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
SCHEMBL26932 1.00
Water SCHEMBL5590072 0.96
SCHEMBL4350862 0.96
SCHEMBL29139338 0.96
Hydrochloric Acid SCHEMBL8976680 0.96
Hydrochloric Acid SCHEMBL7086640 0.96
SCHEMBL337626 0.96
SCHEMBL7880214 0.96
Ammonia Solution, Strong SCHEMBL2733996 0.96
SCHEMBL28465116 0.96 ALOX15 (0.38) ALOX15TSHRCA2SLC34A1PGK1

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-5178963-A Lithographic printing plates HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed