SCHEMBL5596342

SCHEMBL5596342

C[Si](C)(c1ccccc1)P(c1cc(Br)cc(Br)c1O)c1cc(Br)cc(Br)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
CYP3A4 P08684 1/20 0.39
TSHR P16473 1/20 0.39
HSPD1 P10809 1/20 0.37
HSPE1 P61604 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
MAPT P10636 5/20 0.35
HSP90AA1 P07900 1/20 0.35
AKR1C4 P17516 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
AKR1C1 Q04828 1/20 0.35
LMNA P02545 2/20 0.35

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
SCHEMBL5595970 0.88 GABRA1 (0.40) GABRA1GABRB1GABRA2GABRB2TDP1
SCHEMBL5596517 0.78 CYP3A4 (0.50) GABRA1GABRB1GABRA2GABRB2TDP1
SCHEMBL5596075 0.73 ALDH1A1 (0.39) MEN1KMT2AMAPTLMNATTR
SCHEMBL5596379 0.71 CYP3A4 (0.46) GABRA1GABRB1GABRA2GABRB2TDP1
SCHEMBL5596914 0.71 ESR1 (0.41) GABRA1GABRB2TDP1CYP3A4TSHR
SCHEMBL5596527 0.69 ALDH1A1 (0.43) GABRA1GABRB2CYP3A4TSHRKMT2A
SCHEMBL5596484 0.69 MEN1 (0.38) CYP3A4TSHRMEN1KMT2AMAPT
SCHEMBL5596434 0.68 CYP3A4 (0.56) GABRA1GABRB1GABRA2GABRB2TDP1
SCHEMBL5596382 0.68 TRPA1 (0.39) TDP1MEN1KMT2AMAPTLMNA
SCHEMBL5596943 0.68 KMT2A (0.47) GABRA1GABRB1GABRA2GABRB2TDP1

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