SCHEMBL5881349

SCHEMBL5881349

C=CC(=O)N[SiH2]CCC(OC)(OC)OC

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PSMB11 A5LHX3 1/20 0.31
PSMA7 O14818 1/20 0.31
PSMB1 P20618 1/20 0.31
PSMA1 P25786 1/20 0.31
PSMA2 P25787 1/20 0.31
PSMA3 P25788 1/20 0.31
PSMA4 P25789 1/20 0.31
PSMB8 P28062 1/20 0.31
PSMB9 P28065 1/20 0.31
PSMA5 P28066 1/20 0.31
PSMB4 P28070 1/20 0.31
PSMB6 P28072 1/20 0.31
PSMB5 P28074 1/20 0.31
PSMB10 P40306 1/20 0.31
PSMB3 P49720 1/20 0.31
PSMB2 P49721 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
SCHEMBL29193066 0.87
SCHEMBL1155743 0.74
SCHEMBL9858498 0.68 TSHR (0.48) TSHRALDH1A1MAPK1TDP1PSMB11
SCHEMBL3811725 0.65
SCHEMBL1521480 0.65
Acrylic Acid SCHEMBL29740918 0.63 LMNA (0.40)
SCHEMBL31661115 0.63 TSHR (0.52) TSHRALDH1A1MAPK1
SCHEMBL3683889 0.61 ZDHHC20 (0.35) TSHRALDH1A1MAPK1TDP1
SCHEMBL28872415 0.61 TSHR (0.39) TSHRALDH1A1MAPK1TDP1PSMB11
SCHEMBL27874628 0.61 ALDH1A1 (0.44) TSHRALDH1A1MAPK1

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
US-6994791-B2 Adsorbent material and method of preparing an adsorbent material AKZO NOBEL N.V. (NL) 2006-02-07 US disclosed
EP-1515800-A1 ADSORBENT MATERIAL AND METHOD OF PREPARING AN ADSORBENT MATERIAL Akzo Nobel N.V. (NL) 2005-03-23 EP disclosed
US-20040059040-A1 Adsorbent material and method of preparing an adsorbent material AKZO NOBEL N.V. (NL) 2004-03-25 US disclosed
WO-2004002618-A1 ADSORBENT MATERIAL AND METHOD OF PREPARING AN ADSORBENT MATERIAL AKZO NOBEL N.V. (NL) 2004-01-08 WO disclosed