SCHEMBL9628326

SCHEMBL9628326

CCc1ccc(O)c(S(=O)(=O)O)c1-c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
HTT P42858 1/20 0.35
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
KDM4E B2RXH2 2/20 0.35
RCE1 Q9Y256 1/20 0.35
TSHR P16473 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CNR2 P34972 1/20 0.34
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAOB P27338 1/20 0.33
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33

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
SCHEMBL547433 0.87 ELANE (0.41) CNR2
SCHEMBL8367595 0.78 TNNI3 (0.41) ESR1ESR2HTTTSHRSMN1; SMN2
SCHEMBL27759679 0.74 MAPT (0.48) ESR1ESR2HTTPTGS1PTGS2
SCHEMBL27957739 0.74 GABRA1 (0.48) ESR1ESR2KDM4ERCE1MAOB
SCHEMBL8365842 0.74 CNR1 (0.40) ESR1ESR2HTTKDM4ETSHR
SCHEMBL11216494 0.73 ESR1 (0.51) ESR1ESR2
SCHEMBL9177949 0.73 KDM4E (0.38) ESR1ESR2HTTKDM4ETSHR
SCHEMBL8367616 0.73 TYR (0.45) ESR1HTTPTGS1PTGS2KDM4E
SCHEMBL11249133 0.73 ELANE (0.40) CNR2POLB
SCHEMBL28020176 0.73 HDAC4 (0.46) KDM4ETSHRSMN1; SMN2HPGDHSD17B10

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
EP-0193197-B1 IMPROVED STATIC RESISTANT X-RAY INTENSIFYING SCREENS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-29 EP disclosed
US-4225653-A X-ray intensifying screen based on rare earth tantalate E. I. DU PONT DE NEMOURS AND COMPANY (US) 1980-09-30 US disclosed