SCHEMBL17265646

SCHEMBL17265646

Nc1ccc(N2CCN(c3ccc(N)c(F)c3)CC2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.52
MAPK1 P28482 4/20 0.52
GAA P10253 4/20 0.52
HTT P42858 3/20 0.52
KDM4E B2RXH2 2/20 0.52
PTK2B Q14289 2/20 0.52
RECQL P46063 1/20 0.52
ALDH1A1 P00352 6/20 0.50
LMNA P02545 6/20 0.50
TDP1 Q9NUW8 3/20 0.50
GFER P55789 3/20 0.50
S100B P04271 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
PKM P14618 1/20 0.50
ALOX15 P16050 1/20 0.50
LGMN Q99538 3/20 0.48
RAD52 P43351 1/20 0.47
IP6K1 Q92551 1/20 0.44

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
SCHEMBL22289269 0.92 ALDH1A1 (0.61) MAPTMAPK1GAAHTTKDM4E
SCHEMBL3376365 0.92 ALDH1A1 (0.56) MAPTMAPK1GAAHTTKDM4E
SCHEMBL14239598 0.91 GAA (0.67) MAPTMAPK1GAAHTTKDM4E
SCHEMBL1127082 0.90 ALDH1A1 (0.65) MAPTMAPK1GAAHTTKDM4E
SCHEMBL17264103 0.87 MAPT (0.43) MAPTMAPK1GAAHTTKDM4E
SCHEMBL596512 0.87 MAPT (0.53) MAPTHTTKDM4ERECQLALDH1A1
SCHEMBL520439 0.87 LGMN (0.67) MAPTMAPK1GAAHTTKDM4E
SCHEMBL22171249 0.86 MAPT (0.51) MAPTMAPK1GAAHTTKDM4E
SCHEMBL4950137 0.86 GAA (0.69) MAPTMAPK1GAAHTTKDM4E
Hydrochloric Acid SCHEMBL22165259 0.85 MAPT (0.50) MAPTMAPK1GAAHTTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150329781-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-11-19 US disclosed
US-20150329781-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2015-11-19 US disclosed