SCHEMBL20649443

SCHEMBL20649443

CC(C)(C)OC(=O)c1ccc(OCCCC(F)(F)F)cc1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
PPARA Q07869 4/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 1/20 0.45
MAOB P27338 1/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL3357545 0.85 MAPT (0.70) MAPTL3MBTL1GAARAB9ACA12
SCHEMBL28751206 0.83 MAPT (0.49) MAPTPPARAL3MBTL1GAAMAOB
SCHEMBL7409800 0.83 MAPT (0.53) MAPTPPARAL3MBTL1GAARAB9A
SCHEMBL1983431 0.82 TDP1 (0.57) MAPTL3MBTL1RAB9ATSHRCA12
SCHEMBL578611 0.81 MAPT (0.54) MAPTPPARAL3MBTL1GAARAB9A
SCHEMBL18406249 0.81 L3MBTL1 (0.71) MAPTPPARAL3MBTL1GAAMAOB
SCHEMBL21448021 0.81 CA12 (0.53) MAPTPPARAL3MBTL1GAAMAOB
SCHEMBL20649442 0.81 PPARA (0.47) MAPTPPARAMAOB
SCHEMBL11032267 0.81 GAA (0.54) MAPTL3MBTL1GAARAB9ATSHR
SCHEMBL26091436 0.81 GAA (0.54) MAPTL3MBTL1GAARAB9ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11028323-B2 Liquid crystal aligning agent containing crosslinking agent and polymer that has site having isocyanate group and/or blocked isocyanate group and site having photoreactivity, liquid crystal alignment film, and liquid crystal display element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2021-06-08 US disclosed
US-10921650-B2 Liquid crystal aligning agent, liquid crystal alignment film and liquid crystal display element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2021-02-16 US disclosed
US-20190023987-A1 LIQUID CRYSTAL ALIGNING AGENT CONTAINING CROSSLINKING AGENT AND POLYMER THAT HAS SITE HAVING ISOCYANATE GROUP AND/OR BLOCKED ISOCYANATE GROUP AND SITE HAVING PHOTOREACTIVITY, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-01-24 US disclosed
US-20190018289-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2019-01-17 US disclosed