SCHEMBL5596245

SCHEMBL5596245

Cc1cc(C)c(O)c(P(c2cc(C)cc(C)c2O)[Si](C)(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.39
GAA P10253 4/20 0.39
ALDH1A1 P00352 3/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PTGS1 P23219 3/20 0.35
PTGS2 P35354 3/20 0.35
TTR P02766 1/20 0.35
ALOX5 P09917 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
HTT P42858 1/20 0.33
PKM P14618 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CYP1A2 P05177 1/20 0.31
CYP2A6 P11509 1/20 0.31
ADORA2A P29274 1/20 0.31

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
SCHEMBL5596075 0.87 ALDH1A1 (0.39) LMNAGAAALDH1A1MAPTKDM4E
SCHEMBL5596223 0.82 MEN1 (0.38) GAAALDH1A1MAPTKDM4EPTGS1
SCHEMBL5596458 0.81 NPC1 (0.39) LMNAALDH1A1MAPTKDM4EPTGS1
SCHEMBL5596608 0.80 ALDH1A1 (0.43) GAAALDH1A1MAPTKDM4EPTGS1
SCHEMBL5595996 0.79 TRPA1 (0.39) LMNAGAAALDH1A1MAPTL3MBTL1
SCHEMBL5596396 0.78 ALDH1A1 (0.34) LMNAGAAALDH1A1MAPTKDM4E
SCHEMBL5596151 0.77 ALDH1A1 (0.48) LMNAGAAALDH1A1MAPTKDM4E
SCHEMBL5595970 0.73 GABRA1 (0.40) LMNAGAAALDH1A1MAPTTTR
SCHEMBL5596432 0.72 GAA (0.40) LMNAGAAALDH1A1MAPTKDM4E
SCHEMBL5596474 0.72 ESR1 (0.41) LMNAALDH1A1MAPTKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed