SCHEMBL7784282

SCHEMBL7784282

C/C(=C\CC(O)COc1c(I)cc(I)cc1I)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
THRB P10828 3/20 0.33
LMNA P02545 3/20 0.33
TTR P02766 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
PDE4D Q08499 2/20 0.33
HSD17B10 Q99714 2/20 0.33
THRA P10827 2/20 0.33
PPARG P37231 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
NR3C1 P04150 1/20 0.33
CYP1A2 P05177 1/20 0.33
HTR1A P08908 1/20 0.33
CYP2C9 P11712 1/20 0.33
TBXA2R P21731 1/20 0.33
NTSR1 P30989 1/20 0.33
HTR2B P41595 1/20 0.33
USP2 O75604 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
SCHEMBL7784290 1.00 MEN1 (0.33) MEN1KMT2ATHRBLMNATTR
SCHEMBL7784278 0.79 HDAC3 (0.30)
SCHEMBL7784274 0.79 HDAC3 (0.30)
SCHEMBL4351803 0.74 LMNA (0.49) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL131676 0.74 LMNA (0.49) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL5023080 0.72 ATM (0.50) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL8656427 0.71 TSHR (0.42) MEN1KMT2ATHRBLMNATTR
SCHEMBL2763358 0.71 MAPT (0.33) ALDH1A1MAPTUSP2ALOX15KDM4E
SCHEMBL7875447 0.71 TSHR (0.41) MEN1KMT2ALMNATTRMAPT
SCHEMBL5050873 0.71 MAPT (0.33) ALDH1A1MAPTUSP2ALOX15KDM4E

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0710475-B1 High refractive index and/or radio-opaque resins systems ABONETICS LTD (GB) 2001-11-21 EP claimed
US-5679710-A DENTAL COMPOSITES LONDON HOSPITAL MEDICAL COLLEGE (GB) 1997-10-21 US claimed
EP-0710475-A1 High refractive index and/or radio-opaque resins systems THE LONDON HOSPITAL MEDICAL COLLEGE (GB) 1996-05-08 EP claimed
EP-0710475-B1 High refractive index and/or radio-opaque resins systems ABONETICS LTD (GB) 2001-11-21 EP disclosed
US-5679710-A DENTAL COMPOSITES LONDON HOSPITAL MEDICAL COLLEGE (GB) 1997-10-21 US disclosed
EP-0710475-A1 High refractive index and/or radio-opaque resins systems THE LONDON HOSPITAL MEDICAL COLLEGE (GB) 1996-05-08 EP disclosed