SCHEMBL6003474

SCHEMBL6003474

CN(C)c1ccc(C=Cc2ccc(C(C#N)=CC#N)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
ALDH1A1 P00352 6/20 0.57
RAB9A P51151 4/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
MAPK1 P28482 2/20 0.57
KDM4E B2RXH2 1/20 0.56
MEN1 O00255 6/20 0.50
KMT2A Q03164 6/20 0.50
APP P05067 5/20 0.50
RELA Q04206 1/20 0.47
PTGS1 P23219 1/20 0.46
NPC1 O15118 3/20 0.45
CASP1 P29466 2/20 0.45
HBB P68871 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
LMNA P02545 2/20 0.45
ALOX15 P16050 1/20 0.45
MITF O75030 1/20 0.45
HSD17B3 P37058 1/20 0.44
CRHBP P24387 1/20 0.43

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
SCHEMBL6003470 1.00 MAPT (0.57) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6753031 0.92 ALDH1A1 (0.57) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6753030 0.92 ALDH1A1 (0.57) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6003812 0.83 NPC1 (0.51) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6003804 0.83 NPC1 (0.51) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6003808 0.83 NPC1 (0.51) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL28444563 0.80 ESR1 (0.44) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL29466258 0.80 MAPT (0.84) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL11661225 0.80 MAPT (0.84) MAPTALDH1A1RAB9AL3MBTL1MAPK1
SCHEMBL6003635 0.76 KDM4E (0.53) MAPTALDH1A1RAB9AL3MBTL1MAPK1

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-7092608-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-15 US disclosed
US-7082244-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-25 US disclosed
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US disclosed
US-20040197064-A1 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2004-10-07 US disclosed