SCHEMBL8516397

SCHEMBL8516397

CC(C)CCCCCCCCCCCCCCCOc1ccc(N)cc1N

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.58
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 2/20 0.58
MAPT P10636 2/20 0.58
MEN1 O00255 1/20 0.58
USP2 O75604 1/20 0.58
TP53 P04637 1/20 0.58
POLB P06746 1/20 0.58
CASP1 P29466 1/20 0.58
HTT P42858 1/20 0.58
CASP7 P55210 1/20 0.58
KMT2A Q03164 1/20 0.58
ATM Q13315 1/20 0.58
PRSS1 P07477 8/20 0.46
TDP1 Q9NUW8 1/20 0.45
HTR1A P08908 1/20 0.40
HTR1D P28221 1/20 0.40
HTR1B P28222 1/20 0.40
TLR8 Q9NR97 1/20 0.38
CYP2C19 P33261 2/20 0.38

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
SCHEMBL16807334 0.88 GAA (0.64) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11217075 0.86 GAA (0.69) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11226585 0.86 GAA (0.69) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11224150 0.86 GAA (0.69) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11225049 0.86 GAA (0.69) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11221321 0.86 GAA (0.69) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11228003 0.84 GAA (0.55) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL11218926 0.84 GAA (0.71) GAAALDH1A1KDM4EMAPTMEN1
Hydrochloric Acid SCHEMBL11233537 0.82 GAA (0.75) GAAALDH1A1KDM4EMAPTMEN1
SCHEMBL23014013 0.81 MAPT (0.74) GAAALDH1A1KDM4EMAPTMEN1

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
EP-0890131-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1999-01-13 EP claimed
WO-1997037273-A2 PROCESS AND MATERIALS FOR INDUCING PRE-TILT IN LIQUID CRYSTALS AND LIQUID CRYSTAL DISPLAYS ALLIANT TECHSYSTEMS INC. (US) 1997-10-09 WO claimed
US-10131842-B2 Liquid crystal alignment agent, liquid crystal alignment film, and liquid crystal display element CHI MEI CORPORATION (TW) 2018-11-20 US disclosed
US-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 US disclosed