SCHEMBL9224372

SCHEMBL9224372

O=S(=O)(O)Oc1cc(O)c(O)c(OS(=O)(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 2/20 0.47
TYR P14679 1/20 0.39
F10 P00742 5/20 0.38
ERN1 O75460 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.33
CA5A P35218 1/20 0.33
EGFR P00533 1/20 0.32
USP2 O75604 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PTGS2 P35354 1/20 0.31
DUSP5 Q16690 1/20 0.31
STS P08842 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
SCHEMBL8020759 0.84 CISD1 (0.41) CISD1TYRF10GLAGAA
SCHEMBL3520079 0.78 CISD1 (0.63) CISD1TYRGLAGAACA5A
SCHEMBL9053013 0.77 CISD1 (0.50) CISD1TYRF10GLAGAA
SCHEMBL8602283 0.76 CISD1 (0.50) CISD1PTGS2DUSP5
SCHEMBL10872659 0.75 CISD1 (0.51) CISD1TYRF10GLAGAA
SCHEMBL5265908 0.75 PTGS2 (0.59) GAACA5AMAPK1SMN1; SMN2PTGS2
SCHEMBL10707163 0.73 CISD1 (0.50) CISD1TYRF10GLAGAA
SCHEMBL17469926 0.72 GLA (0.47) CISD1F10GLAGAASLC22A6
SCHEMBL8024102 0.72 FABP1 (0.47) CISD1TYRF10GLAGAA
SCHEMBL4636298 0.71 CISD1 (0.41) CISD1TYRF10GLAGAA

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
US-5429918-A Antifading agent FUJI PHOTO FILM CO., LTD. (JP) 1995-07-04 US disclosed
EP-0036584-A2 Chelating ion exchanger based organic polymer and process for its preparation RIEDEL-DE HAEN AKTIENGESELLSCHAFT (DE) 1981-09-30 EP disclosed