SCHEMBL12153243

SCHEMBL12153243

CC(c1ccc(OCc2cc(OCc3cc(OCc4ccc(SOOO)cc4)cc(OCc4ccc(SOOO)cc4)c3)cc(OCc3cc(OCc4ccc(SOOO)cc4)cc(OCc4ccc(SOOO)cc4)c3)c2)cc1)(c1ccc(OCc2cc(OCc3cc(OCc4ccc(S(=O)(=O)O)cc4)cc(OCc4ccc(S(=O)(=O)O)cc4)c3)cc(OCc3cc(OCc4ccc(S(=O)(=O)O)cc4)cc(OCc4ccc(S(=O)(=O)O)cc4)c3)c2)cc1)c1ccc(OCc2cc(OCc3cc(OCc4ccc(S(=O)(=O)O)cc4)cc(OCc4ccc(S(=O)(=O)O)cc4)c3)cc(OCc3cc(OCc4ccc(S(=O)(=O)O)cc4)cc(OCc4ccc(S(=O)(=O)O)cc4)c3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRZ1 P23471 2/20 0.38
NR4A2 P43354 1/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
AR P10275 2/20 0.37
APP P05067 1/20 0.35
MAOB P27338 2/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
ADAMTS4 O75173 1/20 0.34
MMP13 P45452 1/20 0.34
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA7 P43166 2/20 0.34
CA9 Q16790 2/20 0.34
PTPRC P08575 1/20 0.34
PTPN2 P17706 1/20 0.34
PTPN1 P18031 1/20 0.34
PTPRB P23467 1/20 0.34

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
SCHEMBL12153259 0.96 AR (0.41) PTPRZ1NR4A2RXRARXRBAR
SCHEMBL14546150 0.88 PTPRZ1 (0.47) PTPRZ1NR4A2RXRARXRBAR
SCHEMBL12153240 0.85 PPARD (0.39) RXRARXRBMAOBPPARDPPARA
SCHEMBL12120865 0.85 PTPRZ1 (0.36) PTPRZ1RXRARXRBMAOBCA12
SCHEMBL9999623 0.84 AR (0.52) NR4A2RXRARXRBARCA12
SCHEMBL12120906 0.83 AR (0.39) ARMAOBMMP13FFAR1
SCHEMBL9999630 0.80 AR (0.57) ARCA12CA1CA2CA7
SCHEMBL14560497 0.79 CA12 (0.35) CA12CA1CA2CA7CA9
SCHEMBL12153239 0.77 PARP10 (0.34) MAOBADAMTS4MMP13PTPRCPTPN2
SCHEMBL14097199 0.72 CA12 (0.40) CA12CA1CA2CA7CA9

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-8049033-B2 Dendrimer solid acid and polymer electrolyte membrane including the same SAMSUNG SDI CO., LTD. (KR) 2011-11-01 US disclosed
US-20070092779-A1 Dendrimer solid acid and polymer electrolyte membrane including the same SAMSUNG SDI CO., LTD. (KR) 2007-04-26 US disclosed