SCHEMBL1920546

SCHEMBL1920546

C=CC(=O)OC(C)C(=O)O.[AlH3]

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.43
HCAR2 Q8TDS4 1/20 0.35
HPGD P15428 1/20 0.33
LMNA P02545 1/20 0.33
ALDH1A1 P00352 4/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 2/20 0.32
CYP3A4 P08684 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL37396 0.98 TSHR (0.45) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL2184214 0.98 TSHR (0.45) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL10953217 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL1919371 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL28190611 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL183980 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL1919847 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL184163 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL1919547 0.95 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL19046763 0.90 TSHR (0.44) TSHRHCAR2HPGDALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8709705-B2 Metal-containing compositions and method of making same PRYOG, LLC (US) 2014-04-29 US claimed
US-20120315451-A1 Metal-Containing Compositions and Method of Making Same PRYOG LLC 2012-12-13 US claimed
US-8802346-B2 Metal compositions and methods of making same PRYOG, LLC (US) 2014-08-12 US disclosed
US-8709705-B2 Metal-containing compositions and method of making same PRYOG, LLC (US) 2014-04-29 US disclosed
US-20120315451-A1 Metal-Containing Compositions and Method of Making Same PRYOG LLC 2012-12-13 US disclosed
US-20110184139-A1 METAL COMPOSITIONS AND METHODS OF MAKING SAME PRYOG, LLC 2011-07-28 US disclosed
EP-2326744-A1 METAL COMPOSITIONS AND METHODS OF MAKING SAME Pryog LLC (US) 2011-06-01 EP disclosed
WO-2010059174-A1 METAL COMPOSITIONS AND METHODS OF MAKING SAME PRYOG, LLC (US) 2010-05-27 WO disclosed