SCHEMBL2235491

SCHEMBL2235491

Nc1cccc(C#CC(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.54
IKBKB O14920 1/20 0.44
ADRB2 P07550 1/20 0.44
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PBRM1 Q86U86 1/20 0.44
CSNK2A2 P19784 1/20 0.43
CSNK2B P67870 1/20 0.43
CSNK2A1 P68400 1/20 0.43
CYP3A4 P08684 1/20 0.41
CASP1 P29466 1/20 0.41
RECQL P46063 1/20 0.41
NPSR1 Q6W5P4 3/20 0.41
PTPRC P08575 1/20 0.40
PTPRG P23470 1/20 0.40
DDX3X O00571 1/20 0.40
ALDH1A1 P00352 2/20 0.40
S1PR2 O95136 1/20 0.40
HSP90AA1 P07900 1/20 0.40
MAPT P10636 1/20 0.40

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
SCHEMBL4968126 0.79 CYP3A4 (0.58) FFAR1IKBKBADRB2RAB9AL3MBTL1
SCHEMBL27627934 0.78 FFAR1 (0.53) FFAR1IKBKBCYP3A4NPSR1ALDH1A1
SCHEMBL29462452 0.77 MAPT (0.62) FFAR1ADRB2RAB9AL3MBTL1CYP3A4
SCHEMBL2811255 0.77 MAPT (0.62) FFAR1ADRB2RAB9AL3MBTL1CYP3A4
SCHEMBL13780436 0.77 CA12 (0.48) NPSR1ALDH1A1S1PR2HSP90AA1MAPT
SCHEMBL5380220 0.77 FFAR1 (0.54) FFAR1NPSR1
SCHEMBL3155146 0.77 FFAR1 (0.54) FFAR1ALDH1A1MAPTHTT
SCHEMBL670363 0.77 CYP2C9 (0.49) RAB9ACYP3A4PTPRCMAPTHTT
SCHEMBL28443913 0.77 FFAR1 (0.57) FFAR1NPSR1ALDH1A1S1PR2HSP90AA1
SCHEMBL2636049 0.77 GFER (0.55) FFAR1CA12CA1CA2CA9

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
EP-2360194-B1 SILOXANE RESIN COMPOSITION AND PROTECTIVE FILM FOR TOUCH PANEL USING SAME TORAY INDUSTRIES (JP) 2015-03-11 EP disclosed
CN-102227455-B Siloxane resin composition and protective film for touch panel using same TORAY INDUSTRIES 2013-11-06 CN disclosed
US-8492450-B2 Siloxane resin composition and protective film for touch panel using the same TORAY INDUSTRIES, INC. (JP) 2013-07-23 US disclosed
CN-102227455-A Siloxane resin composition and protective film for touch panel using same TORAY INDUSTRIES 2011-10-26 CN disclosed
US-20110230584-A1 SILOXANE RESIN COMPOSITION AND PROTECTIVE FILM FOR TOUCH PANEL USING THE SAME TORAY INDUSTRIES, INC. (JP) 2011-09-22 US disclosed
EP-2360194-A1 SILOXANE RESIN COMPOSITION AND PROTECTIVE FILM FOR TOUCH PANEL USING SAME Toray Industries, Inc. (JP) 2011-08-24 EP disclosed