SCHEMBL8959221

SCHEMBL8959221

CCO[Si](CCCC(C(=O)O)C(=O)O)(OCC)OCC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.33
CA2 P00918 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM1 P11229 1/20 0.32
AKR1A1 P14550 1/20 0.32
CHRM3 P20309 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
ADRA1A P35348 1/20 0.32
HRH1 P35367 1/20 0.32
DRD3 P35462 1/20 0.32
SLC6A3 Q01959 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
GPR84 Q9NQS5 3/20 0.31
FFAR1 O14842 1/20 0.31
MAPT P10636 1/20 0.31
LCK P06239 1/20 0.31
PPARD Q03181 1/20 0.31
ZDHHC20 Q5W0Z9 1/20 0.31

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
SCHEMBL29048433 0.91 TDP1 (0.31) TDP1
SCHEMBL9174327 0.88 CHRM1 (0.34) TDP1CA2MAPK1CHRM1AKR1A1
SCHEMBL15384741 0.86
SCHEMBL1268292 0.85 TDP1 (0.45) TDP1MAPK1MAPTMEN1KMT2A
SCHEMBL28940743 0.85 CA1 (0.33) CA2
SCHEMBL29066700 0.85 BLM (0.44) TBXAS1
SCHEMBL8747473 0.83 CA1 (0.38) TDP1CA2MAPK1MEN1KMT2A
SCHEMBL28139468 0.83 MEN1 (0.33) MEN1KMT2A
SCHEMBL4452841 0.83 RNPEP (0.44)
SCHEMBL9142688 0.82 TDP1 (0.33) TDP1CA2MAPK1CHRM1AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0480386-B1 Polytetraalkylammonium and polytrialkylamine containing ligands bonded to inorganic supports and processes of using the same for removing and concentrating desired ions from solutions UNIV BRIGHAM YOUNG (US) 1996-01-03 EP claimed