SCHEMBL7595079

SCHEMBL7595079

CCCCCC(C=O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.36
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
TRPA1 O75762 1/20 0.33
DDAH1 O94760 1/20 0.33
GAPDH P04406 1/20 0.33
MAPT P10636 1/20 0.33
CTSK P43235 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
SCHEMBL4936168 0.98 ADH1B (0.36) CA2TSHRSMN1; SMN2ADH1BADH1C
SCHEMBL9425960 0.83 DUT (0.34)
SCHEMBL8899734 0.83 CA2 (0.36) CA2
SCHEMBL15645495 0.83 CA2 (0.33) CA2TSHR
SCHEMBL15646726 0.83 CA2 (0.33) CA2TSHR
SCHEMBL6532524 0.83 CA2 (0.33) CA2TSHR
SCHEMBL18022041 0.81 CA2 (0.33) CA2
SCHEMBL15646516 0.81 TSHR (0.35) CA2TSHR
SCHEMBL15645048 0.81 TSHR (0.35) CA2TSHR
SCHEMBL9116132 0.80 ADH1B (0.40) TSHRSMN1; SMN2ADH1BADH1CADH1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0746551-B1 OPTICALLY PURE 4-ARYL-2-HYDROXYTETRONIC ACIDS UNIV OHIO STATE RES FOUND (US) 2002-09-04 EP disclosed
US-5504108-A ANTIAGGLOMERANTS, ANTIARTHRITIC AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1996-04-02 US disclosed
WO-1995023139-A1 OPTICALLY PURE 4-ARYL-2-HYDROXYTETRONIC ACIDS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1995-08-31 WO disclosed
US-5399721-A Anticoagulant; prepared from aldehyde THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 1995-03-21 US disclosed