SCHEMBL1472419

SCHEMBL1472419

CC(C)CCc1ccccc1C(=O)OO

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.49
ALDH1A1 P00352 3/20 0.47
LMNA P02545 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 3/20 0.46
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAP1LC3B Q9GZQ8 1/20 0.41
MAP1LC3A Q9H492 1/20 0.41
SCN1A P35498 3/20 0.40
SCN2A Q99250 3/20 0.40
SCN3A Q9NY46 3/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
KCNA5 P22460 1/20 0.39
FOLH1 Q04609 1/20 0.39
POLB P06746 1/20 0.38
HTR2A P28223 1/20 0.37

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
SCHEMBL23259449 0.87 ALDH1A1 (0.64) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL496788 0.83 HTT (0.55) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL4051383 0.83 ALDH1A1 (0.49) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL2457497 0.83 ALDH1A1 (0.44) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL4253647 0.81 SCN1A (0.44) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL1494672 0.81 ALDH1A1 (0.51) ALDH1A1LMNAKMT2ATSHRHSD17B10
SCHEMBL442094 0.81 FOLH1 (0.59) ALDH1A1KMT2ATSHRKDM4EHSD17B10
SCHEMBL14748129 0.81 ALDH1A1 (0.44) HTTALDH1A1LMNAKMT2ATSHR
SCHEMBL28080434 0.79 ALDH1A1 (0.50) ALDH1A1LMNAKMT2ATSHRSCN1A
SCHEMBL1532511 0.78 TSHR (0.50) HTTALDH1A1LMNAKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2907568-B1 A FRAGRANCE-DELIVERY COMPOSITION COMPRISING PERSULFATE ION-CROSSLINKED POLYVINYL ALCOHOL MICROCAPSULES AND METHOD OF USE THEREOF ENCAPSYS LLC (US) 2017-12-06 EP disclosed
EP-2907568-A1 A FRAGRANCE-DELIVERY COMPOSITION COMPRISING PERSULFATE ION-CROSSLINKED POLYVINYL ALCOHOL MICROCAPSULES AND METHOD OF USE THEREOF APPVION, INC. (US) 2015-08-19 EP disclosed
US-8440265-B2 Water- and heat-resistant scratch-and-sniff coating APPLETON PAPERS INC. (US) 2013-05-14 US disclosed
US-20110253584-A1 WATER- AND HEAT-RESISTANT SCRATCH-AND-SNIFF COATING ENCAPSYS, LLC 2011-10-20 US disclosed
EP-2364205-A2 A FRAGRANCE-DELIVERY COMPOSITION COMPRISING BORON AND PERSULFATE ION-CROSSLINKED POLYVINYL ALCOHOL MICROCAPSULES AND METHOD OF USE THEREOF APPLETON PAPERS INC. (US) 2011-09-14 EP disclosed
US-7915215-B2 Fragrance-delivery composition comprising boron and persulfate ion-crosslinked polyvinyl alcohol microcapsules and method of use thereof APPLETON PAPERS INC. (US) 2011-03-29 US disclosed
US-20100099594-A1 Fragrance-delivery composition comprising boron and persulfate ion-crosslinked polyvinyl alcohol microcapsules and method of use thereof IPS ADHESIVES LLC 2010-04-22 US disclosed
WO-2010044834-A2 A FRAGRANCE-DELIVERY COMPOSITION COMPRISING BORON AND PERSULFATE ION-CROSSLINKED POLYVINYL ALCOHOL MICROCAPSULES AND METHOD OF USE THEREOF APPLETON PAPERS INC. (US) 2010-04-22 WO disclosed
US-20080176781-A1 Perfumes for linear citrus release in rinse-off systems QUEST INTERNATIONAL SERVICES B.V. (NL) 2008-07-24 US disclosed