SCHEMBL13048526

SCHEMBL13048526

O=S(=O)(O)c1ccc(OCCOc2ccc(-c3cc(-c4ccc(OCCOc5ccc(SOOO)cc5)cc4)cc(-c4ccc(OCCOc5ccc(S(=O)(=O)O)cc5)cc4)c3)cc2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 2/20 0.33
▸ MMP2 P08253 5/20 0.33
▸ MMP13 P45452 4/20 0.33
▸ MMP9 P14780 3/20 0.33
▸ MMP3 P08254 3/20 0.33
▸ MMP1 P03956 2/20 0.33
▸ MMP14 P50281 2/20 0.33
▸ MMP12 P39900 1/20 0.33
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA7 P43166 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ HDAC3 O15379 1/20 0.32
▸ HDAC4 P56524 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC7 Q8WUI4 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC10 Q969S8 1/20 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
SCHEMBL14560497 0.91 CA12 (0.35) PTPN11CA12CA1CA2CA7
SCHEMBL14496675 0.89 LMNA (0.37) PTPN11CA12CA1CA2CA9
SCHEMBL14097199 0.87 CA12 (0.40) CA12CA1CA2CA7CA9
SCHEMBL13310832 0.85 LMNA (0.41) PTPN11MMP2MMP9CA12CA1
SCHEMBL13428187 0.85 LMNA (0.41) PTPN11MMP2MMP9CA12CA1
SCHEMBL13538730 0.80 LMNA (0.45) PTPN11CA12CA1CA2CA7
SCHEMBL13048653 0.78 L3MBTL1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL13048580 0.78 L3MBTL1 (0.45) CA12CA1CA2CA7CA9
SCHEMBL13428210 0.77 TDP1 (0.41) MMP2MMP13MMP9MMP3MMP1
SCHEMBL14455222 0.76 LMNA (0.41) PTPN11TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7833690-B2 Photoacid generators and lithographic resists comprising the same THE UNIVERSITY OF NORTH CAROLINA AT CHARLOTTE (US) 2010-11-16 — — US disclosed
US-20070117043-A1 Photoacid generators and lithographic resists comprising the same NATIONAL SCIENCE FOUNDATION 2007-05-24 — — US disclosed
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