SCHEMBL17264102

SCHEMBL17264102

Cc1cc(N2CCC(C3CCN(c4ccc(N)c(C)c4)CC3)CC2)ccc1N

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.61
RAD52 P43351 2/20 0.61
MAPT P10636 4/20 0.46
KDM4E B2RXH2 2/20 0.46
LGMN Q99538 5/20 0.45
MAPK1 P28482 2/20 0.45
HTT P42858 2/20 0.45
RECQL P46063 1/20 0.45
PTK2B Q14289 1/20 0.45
ALDH1A1 P00352 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
S100B P04271 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
KMT2A Q03164 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ADRB1 P08588 1/20 0.43
THRB P10828 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
SCHEMBL29990255 0.88 GAA (0.59) GAARAD52MAPTKDM4ELGMN
SCHEMBL15358759 0.87 GAA (0.77) GAARAD52MAPTKDM4ELGMN
SCHEMBL6151434 0.87 GAA (0.77) GAARAD52MAPTKDM4ELGMN
SCHEMBL6220205 0.86 GAA (0.58) GAARAD52MAPTKDM4ELGMN
SCHEMBL10208410 0.83 GAA (0.55) GAARAD52MAPTKDM4ELGMN
SCHEMBL29218858 0.83 GAA (0.63) GAARAD52MAPTKDM4ELGMN
SCHEMBL2923577 0.83 GAA (0.67) GAARAD52MAPTKDM4ELGMN
SCHEMBL7032717 0.83 GAA (0.67) GAARAD52MAPTKDM4ELGMN
SCHEMBL25187995 0.82 GAA (0.54) GAARAD52MAPTKDM4ELGMN
SCHEMBL24206625 0.82 GAA (0.57) GAARAD52MAPTKDM4ELGMN

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-9453164-B2 Liquid crystal alignment agent and uses thereof CHI MEI CORPORATION (TW) 2016-09-27 US disclosed
US-9453164-B2 Liquid crystal alignment agent and uses thereof CHI MEI CORPORATION (TW) 2016-09-27 US disclosed
US-20150329779-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND USES THEREOF CHI MEI CORPORATION (TW) 2015-11-19 US disclosed
US-20150329779-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND USES THEREOF CHI MEI CORPORATION (TW) 2015-11-19 US disclosed