SCHEMBL9836680

SCHEMBL9836680

CCCC(=O)O[Si](CC(=O)O)(CC(=O)O)CC(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
FFAR3 O14843 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
AKR1B1 P15121 1/20 0.34
PAM P19021 2/20 0.34
GPR84 Q9NQS5 7/20 0.33
PPARG P37231 7/20 0.33
PPARD Q03181 7/20 0.33
PPARA Q07869 7/20 0.33
HDAC11 Q96DB2 5/20 0.33
TSHR P16473 5/20 0.33
PTPN1 P18031 3/20 0.33
TLR2 O60603 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
FABP4 P15090 2/20 0.33

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
SCHEMBL9838249 0.82 FFAR3 (0.41) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL10776904 0.79 ALDH1A1 (0.52) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL5051401 0.74 ALDH1A1 (0.57) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL466165 0.72 ALDH1A1 (0.55) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL13666970 0.72 ALDH1A1 (0.55) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL30112934 0.72 ALDH1A1 (0.55) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL16325170 0.71 ALDH1A1 (0.43) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL28786280 0.70 ALDH1A1 (0.52) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL10774410 0.70 ALDH1A1 (0.52) ALDH1A1FFAR3HDAC3HDAC1HDAC2
SCHEMBL23322474 0.68 ALDH1A1 (0.50) ALDH1A1FFAR3HDAC3HDAC1HDAC2

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-5061301-A Sulfonating polysulfone membrane followed by grafting with polysiloxanes and crosslinking KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1991-10-29 US claimed
US-5061301-A Sulfonating polysulfone membrane followed by grafting with polysiloxanes and crosslinking KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1991-10-29 US disclosed