SCHEMBL7247668

SCHEMBL7247668

CCOc1cc(/C=C/C(=O)OC)ccc1OS(=O)(=O)C(F)(F)F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.53
KDM4E B2RXH2 4/20 0.50
GAA P10253 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 3/20 0.49
ALDH1A1 P00352 2/20 0.49
JAK2 O60674 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
TOP2A P11388 5/20 0.48
POLB P06746 1/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.48
MEN1 O00255 1/20 0.47
EPHX2 P34913 1/20 0.47
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46

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
SCHEMBL7247670 1.00 FDPS (0.53) FDPSKDM4EGAAKMT2AMAPT
SCHEMBL4621805 0.90 KDM4E (0.62) KDM4EGAAKMT2AMAPTALDH1A1
SCHEMBL5349276 0.84 FDPS (0.72) FDPSKDM4EGAAKMT2AMAPT
SCHEMBL5349280 0.84 FDPS (0.72) FDPSKDM4EGAAKMT2AMAPT
SCHEMBL2085644 0.83 KDM4E (0.50) FDPSKDM4EGAAMAPTALDH1A1
SCHEMBL2001231 0.80 GAA (0.53) FDPSKDM4EGAAKMT2AMAPT
SCHEMBL2391351 0.80 TTR (0.50) FDPSMAPTALDH1A1NPC1RAB9A
SCHEMBL2390189 0.79 TTR (0.52) FDPSNPC1RAB9ATTRAPP
SCHEMBL4215750 0.79 ALDH1A1 (0.47) KDM4EGAAKMT2AMAPTALDH1A1
SCHEMBL4215757 0.79 ALDH1A1 (0.47) KDM4EGAAKMT2AMAPTALDH1A1

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-6632909-B2 Alkylenedi- acrylates and acrylamides containing phenyl groups substituted with at least two alkoxy or fluoroalkoxy groups; use in orientation layers for liquid crystals, and in optical components, in particular hybrid layer elements. ROLIC AG (CH) 2003-10-14 US disclosed
US-20020061996-A1 Photocrosslinkable polymers BUCHECKER RICHARD (CH) 2002-05-23 US disclosed