SCHEMBL6914451

SCHEMBL6914451

O=S(=O)([O-])c1cc(Br)ccc1Br.O=S(=O)([O-])c1cc(Br)ccc1Br.[Cd+2]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
CA2 P00918 3/20 0.41
S100A4 P26447 2/20 0.41
HSP90AA1 P07900 1/20 0.41
TLR9 Q9NR96 1/20 0.41
EDNRB P24530 2/20 0.40
EDNRA P25101 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CTSL P07711 2/20 0.38
CTSS P25774 2/20 0.38
CTSK P43235 2/20 0.38
KMT2A Q03164 2/20 0.38
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
CTSC P53634 1/20 0.38
MEN1 O00255 1/20 0.38
FTO Q9C0B1 1/20 0.37
PTPRC P08575 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CTSB P07858 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
SCHEMBL6914542 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL6907770 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL6912831 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL6913062 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL6913341 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL9486268 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
Zinc Ion SCHEMBL6909025 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL6912839 0.96 LMNA (0.42) LMNACA2S100A4HSP90AA1TLR9
SCHEMBL10454714 0.80 CA2 (0.50) LMNACA2ALDH1A1CA12CA9
Potassium Ion SCHEMBL585213 0.79 CA2 (0.44) LMNACA2ALDH1A1CA12CA9

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-6830704-B2 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. (JP) 2004-12-14 US disclosed
US-20030135016-A1 Contains a Lewis acid metal salt and a compound having clathrating ability. TOAGOSEI CO., LTD. 2003-07-17 US disclosed
US-6547985-B1 Adhesive mixture TOGOSEI CO., LTD. (JP) 2003-04-15 US disclosed