SCHEMBL5596121

SCHEMBL5596121

C[Si](c1ccccc1)(c1ccccc1)P(c1c(O)ccc2ccccc12)c1c(O)ccc2ccccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN22 Q9Y2R2 1/20 0.43
G6PD P11413 1/20 0.41
POLB P06746 1/20 0.41
HSD17B10 Q99714 2/20 0.40
CYP1A2 P05177 2/20 0.40
USP2 O75604 1/20 0.40
PAK1 Q13153 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KDM4E B2RXH2 4/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
GAA P10253 2/20 0.38
GLA P06280 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
THRB P10828 1/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ERN1 O75460 1/20 0.38
KMT2A Q03164 2/20 0.37

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
SCHEMBL5596067 0.87 PTPN22 (0.43) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596544 0.83 USP2 (0.48) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596591 0.77 PTPN22 (0.43) PTPN22HSD17B10CYP1A2CYP2C9CYP2C19
SCHEMBL5596870 0.75 PTPN22 (0.56) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596928 0.70 PTPN22 (0.50) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5605244 0.70 CYP1A2 (0.50) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596711 0.70 PTPN22 (0.50) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5595961 0.69 PTPN22 (0.48) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596936 0.69 HSD17B10 (0.48) PTPN22G6PDPOLBHSD17B10CYP1A2
SCHEMBL5596474 0.68 ESR1 (0.41) POLBHSD17B10KDM4EMAPTALDH1A1

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