SCHEMBL14853071

SCHEMBL14853071

CCOC(=O)CC(=O)/C=C/C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
MGAM O43451 1/20 0.50
SI P14410 1/20 0.50
MGAM2 Q2M2H8 1/20 0.50
HCAR2 Q8TDS4 1/20 0.38
ALDH1A1 P00352 5/20 0.38
TRPA1 O75762 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 2/20 0.36
POLB P06746 2/20 0.35
POLA1 P09884 1/20 0.35
CYP2C9 P11712 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 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
SCHEMBL29446 0.78
SCHEMBL442803 0.78
SCHEMBL600328 0.78
SCHEMBL17135006 0.78 HCAR2 (0.42) GAAMGAMSIMGAM2HCAR2
SCHEMBL11378100 0.76 GAA (0.58) GAAMGAMSIMGAM2HCAR2
SCHEMBL16867605 0.76 GAA (0.58) GAAMGAMSIMGAM2HCAR2
SCHEMBL8213559 0.74 ALDH1A1 (0.44) GAAMGAMSIMGAM2HCAR2
SCHEMBL4413875 0.74 HCAR2 (0.47) GAAMGAMSIMGAM2HCAR2
SCHEMBL17031441 0.73
SCHEMBL25765729 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9328205-B2 Iron(III) containing complex and condensation reaction catalysts, methods for preparing the catalysts, and compositions containing the catalysts DOW CORNING CORPORATION (US) 2016-05-03 US disclosed
US-20140371056-A1 Iron(III) Containing Complex and Condensation Reaction Catalysts, Methods for Preparing the Catalysts, and Compositions Containing the Catalysts DOW COMING CORPORATION (US) 2014-12-18 US disclosed
WO-2013052585-A2 IRON(III) CONTAINING COMPLEX AND CONDENSATION REACTION CATALYSTS, METHODS FOR PREPARING THE CATALYSTS, AND COMPOSITIONS CONTAINING THE CATALYSTS DOW CORNING CORPORATION (US) 2013-04-11 WO disclosed