SCHEMBL2535258

SCHEMBL2535258

C=C(C)C(=O)NCCOCCOCCO

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
THRB P10828 2/20 0.40
TSHR P16473 5/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
EPHX2 P34913 1/20 0.36
HTT P42858 1/20 0.35
MAPT P10636 1/20 0.35
TGFBR1 P36897 1/20 0.35
ACHE P22303 1/20 0.34
ALDH1A1 P00352 5/20 0.33
ATG4B Q9Y4P1 1/20 0.33
TP53 P04637 2/20 0.32
HIF1A Q16665 2/20 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
SCHEMBL29519084 1.00 MEN1 (0.44) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL7530528 1.00 MEN1 (0.44) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL29519318 1.00 MEN1 (0.44) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL29519177 1.00 MEN1 (0.44) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL50311 0.98 MEN1 (0.41) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL18016179 0.92 MEN1 (0.50) MEN1KMT2ATHRBTSHRSMN1; SMN2
SCHEMBL13862904 0.92 MEN1 (0.50) MEN1KMT2ATHRBTSHRSMN1; SMN2
SCHEMBL9420752 0.91 MEN1 (0.40) MEN1KMT2ATHRBTSHRMAPK1
SCHEMBL12036308 0.90 MEN1 (0.47) MEN1KMT2ATHRBTSHRSMN1; SMN2
SCHEMBL16639652 0.85 MEN1 (0.44) MEN1KMT2ATHRBTSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11851822-B2 Oil-resistant agent for paper DAIKIN INDUSTRIES, LTD. (JP) 2023-12-26 US disclosed
US-8268908-B2 Pigment dispersion liquid, inkjet recording ink, inkjet recording method, ink cartridge and inkjet recording apparatus CANON FINETECH INC. (JP) 2012-09-18 US disclosed
WO-2012049453-A2 COMPOSITIONS FOR TOPICAL APPLICATIONS VECTUM PHARMA S.L. (ES) 2012-04-19 WO disclosed
US-8043423-B2 Pigment dispersion liquid, ink jet recording ink, ink jet recording method, ink cartridge and ink jet recording apparatus CANON FINETECH INC. (JP) 2011-10-25 US disclosed
US-20100021635-A1 PIGMENT DISPERSION LIQUID, INKJET RECORDING INK, INKJET RECORDING METHOD, INK CARTRIDGE AND INKJET RECORDING APPARATUS CANON FINETECH INC. (JP) 2010-01-28 US disclosed
US-20090162552-A1 PIGMENT DISPERSION LIQUID, INK JET RECORDING INK, INK JET RECORDING METHOD, INK CARTRIDGE AND INK JET RECORDING APPARATUS CANON FINETECH INC. (JP) 2009-06-25 US disclosed