SCHEMBL5089853

SCHEMBL5089853

COc1c(Br)cccc1[Si](C)(C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 2/20 0.37
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HPGD P15428 3/20 0.33
HSD17B10 Q99714 3/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
TUBB1 Q9H4B7 4/20 0.33
EGFR P00533 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
TUBB4A P04350 2/20 0.32
TUBB P07437 2/20 0.32
TUBA3C P0DPH7 2/20 0.32
TUBA1B P68363 2/20 0.32
TUBA4A P68366 2/20 0.32
TUBB4B P68371 2/20 0.32
TUBB3 Q13509 2/20 0.32

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
SCHEMBL5090600 0.81 NQO2 (0.41) NQO2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL6677844 0.81 CASR (0.30)
SCHEMBL5083850 0.79 ALDH1A1 (0.30) KDM4EALDH1A1SMN1; SMN2
SCHEMBL5089753 0.78 MEN1 (0.40) KDM4EALDH1A1HPGDTSHRGAA
SCHEMBL5086998 0.74 CA2 (0.34) ALDH1A1HPGDHSD17B10TSHREGFR
SCHEMBL5084191 0.74 ACHE (0.39) NQO2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL31546289 0.74 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL16815975 0.74 SMN1; SMN2 (0.39) KDM4EALDH1A1HPGDHSD17B10TSHR
SCHEMBL364729 0.73 ALDH1A1 (0.46) NQO2KDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL3679275 0.71 CA1 (0.50) NQO2KDM4EALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498178-B1 Transition metal complex and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-06-11 EP disclosed
EP-1498178-A2 Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex and process for producing olefin polymers Sumitomo Chemical Company, Limited (JP) 2005-01-19 EP disclosed
EP-0842939-B1 OLEFIN POLYMERIZATION CATALYST CONTAINING A TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6329478-B1 SOLUBILITY IN SATURATED HYDROCARBON SOLVENTS SUMITMO CHEMICAL COMPANY, LIMITED 2001-12-11 US disclosed
EP-0842939-A1 TRANSITION METAL COMPLEX, PROCESS FOR THE PREPARATION THEREOF, POLYMERIZATION CATALYST FOR OLEFINS CONTAINING THE COMPLEX, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-20 EP disclosed