SCHEMBL5596591

SCHEMBL5596591

C[Si](c1ccccc1)(c1ccccc1)P(c1ccc2ccccc2c1O)c1ccc2ccccc2c1O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.43
LDHA P00338 1/20 0.41
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL5595937 0.87 PTPN22 (0.43) PTPN22LDHACYP1A2CYP2D6CYP2C9
SCHEMBL5596903 0.83 PTPN22 (0.53) PTPN22LDHACYP1A2CYP2C9CYP2C19
SCHEMBL5596121 0.77 PTPN22 (0.43) PTPN22CYP1A2CYP2C9HPGDCYP2C19
SCHEMBL5596608 0.73 ALDH1A1 (0.43) CYP2C9HPGDHSD17B10KMT2A
SCHEMBL5596424 0.73 PTPN22 (0.54) PTPN22LDHACYP1A2CYP2D6CYP2C9
SCHEMBL5596626 0.72 ESR1 (0.35)
SCHEMBL5596474 0.72 ESR1 (0.41) HPGDHIF1AHSD17B10NPC1RAB9A
SCHEMBL5596299 0.70 PTPN22 (0.50) PTPN22LDHACYP1A2CYP2D6CYP2C9
SCHEMBL5596306 0.70 PTPN22 (0.50) PTPN22LDHACYP1A2CYP2D6CYP2C9
SCHEMBL5596958 0.70 CA2 (0.48) CYP1A2CYP2C9CYP2C19MEN1KMT2A

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