SCHEMBL9344498

SCHEMBL9344498

CC(C)(O)c1ccc(CCCOCCCCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.36
HRH3 Q9Y5N1 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HRH4 Q9H3N8 1/20 0.35
PPARA Q07869 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP2J2 P51589 1/20 0.34

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
SCHEMBL9343520 0.85 HRH3 (0.38) PPARGHRH3TDP1L3MBTL1HRH4
Hydrogen Peroxide SCHEMBL9347071 0.84 SMN1; SMN2 (0.38) PPARGHRH3TDP1L3MBTL1HRH4
SCHEMBL9342904 0.84 HRH3 (0.34) PPARGHRH3HRH4MEN1KMT2A
SCHEMBL6487611 0.82 CALM1 (0.41) PPARG
SCHEMBL3684392 0.79 PPARG (0.38) PPARGPPARA
SCHEMBL23120948 0.79 KCNH3 (0.37) MEN1KMT2A
SCHEMBL3693776 0.78 TDP1 (0.36) PPARGTDP1L3MBTL1HRH4PPARA
SCHEMBL23121114 0.77 L3MBTL1 (0.43) HRH3TDP1L3MBTL1HRH4MEN1
SCHEMBL9343496 0.77 KCNH2 (0.34)
SCHEMBL23120633 0.76 SMYD2 (0.35)

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-0328643-B1 (alpha)-HYDROPEROXYISOPROPYLPHENYL COMPOUNDS AND PROCESS FOR THEIR PREPARATION TERUMO CORP (JP) 1994-07-06 EP disclosed
US-5043142-A Measuring peroxide-active substances TERUMO KABUSHIKI KAISHA (JP) 1991-08-27 US disclosed