SCHEMBL10065491

SCHEMBL10065491

C=CC(=O)OCC(C)(C)CN1C(=O)C(C)=C(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
TP53 P04637 3/20 0.41
HIF1A Q16665 3/20 0.41
CYP3A4 P08684 2/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BLM P54132 1/20 0.36
WRN Q14191 1/20 0.36
THRB P10828 1/20 0.36
TSHR P16473 6/20 0.35
HPGD P15428 1/20 0.34
PKM P14618 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL10065492 0.79 BLM (0.36) ALDH1A1BLMWRNTHRBTSHR
SCHEMBL262028 0.76 ALDH1A1 (0.59) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL7047458 0.74 TSHR (0.46) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL10065490 0.72 TSHR (0.52) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL18495622 0.72 TSHR (0.50) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL230726 0.71 ALDH1A1 (0.64) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL7107705 0.71 ALDH1A1 (0.64) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL9576144 0.71 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL1353827 0.71 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL10523874 0.71 ALDH1A1 (0.53) ALDH1A1TP53HIF1ACYP3A4MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9284461-B2 Aqueous ink composition, inkjet recording method, and inkjet printed article FUJIFILM CORPORATION (JP) 2016-03-15 US disclosed
US-20150132544-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20150132544-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-8852727-B2 Ink composition, image forming method, and printed matter FUJIFILM CORPORATION (JP) 2014-10-07 US disclosed
US-8852727-B2 Ink composition, image forming method, and printed matter FUJIFILM CORPORATION (JP) 2014-10-07 US disclosed
US-8815980-B2 Ink composition for inkjet recording, inkjet recording method and printed material obtained by inkjet recording FUJIFILM CORPORATION (JP) 2014-08-26 US disclosed
US-8815980-B2 Ink composition for inkjet recording, inkjet recording method and printed material obtained by inkjet recording FUJIFILM CORPORATION (JP) 2014-08-26 US disclosed
US-20130295344-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATTER FUJIFILM CORPORATION (JP) 2013-11-07 US disclosed
US-20130295344-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATTER FUJIFILM CORPORATION (JP) 2013-11-07 US disclosed
WO-2013083956-A1 RADIATION CURABLE INKS SERICOL LIMITED (GB) 2013-06-13 WO disclosed
US-20120213978-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-08-23 US disclosed
US-20120213978-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-08-23 US disclosed
US-20120052256-A1 AQUEOUS INK COMPOSITION, INKJET RECORDING METHOD, AND INKJET PRINTED ARTICLE FUJIFILM CORPORATION (JP) 2012-03-01 US disclosed
US-20120052256-A1 AQUEOUS INK COMPOSITION, INKJET RECORDING METHOD, AND INKJET PRINTED ARTICLE FUJIFILM CORPORATION (JP) 2012-03-01 US disclosed