SCHEMBL28501797

SCHEMBL28501797

CC[Si](CC)(CC)OS(=O)(=O)c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
TSHR P16473 3/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.38
NAPRT Q6XQN6 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
CASR P41180 2/20 0.33
S1PR3 Q99500 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
F2 P00734 3/20 0.33
CASP6 P55212 1/20 0.33
PSIP1 O75475 1/20 0.32
HTR6 P50406 1/20 0.32
PTPN11 Q06124 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
SCHEMBL28501795 0.92 SMN1; SMN2 (0.41) ALDH1A1TSHRSMN1; SMN2CA1CA2
SCHEMBL28501773 0.83 LMNA (0.42) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL28499929 0.81 ALDH1A1 (0.47) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL2057944 0.79 PSIP1 (0.48) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL28501772 0.77 CA2 (0.35) ALDH1A1TSHRTDP1SMN1; SMN2CA1
SCHEMBL3212747 0.75 TSHR (0.52) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL1563586 0.74 ALDH1A1 (0.70) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL151444 0.74 ALDH1A1 (0.70) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL8132585 0.73 PSIP1 (0.56) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2
SCHEMBL28316919 0.73 ALDH1A1 (0.53) ALDH1A1TSHRHSD17B10TDP1SMN1; SMN2

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
CN-112143028-B Application of substituted silicon-based benzene sulfonate in flame-retardant modification of high polymer material and flame-retardant high polymer material 中国科学院宁波材料技术与工程研究所 2021-07-27 CN disclosed
CN-112143028-A Application of substituted silicon-based benzene sulfonate in flame-retardant modification of high polymer material and flame-retardant high polymer material 中国科学院宁波材料技术与工程研究所 2020-12-29 CN disclosed