SCHEMBL29036162

SCHEMBL29036162

C1=CN(CCNc2ccccc2)c2ccccc2O1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.35
KDM1A O60341 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HTR7 P34969 1/20 0.32
CACNA1B Q00975 3/20 0.31
DRD4 P21917 1/20 0.31

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
SCHEMBL30534482 1.00 ALDH1A1 (0.39) ALDH1A1MAPTL3MBTL1KDM1AMEN1
SCHEMBL29036158 0.89 MAPT (0.42) ALDH1A1MAPTL3MBTL1KMT2A
SCHEMBL30534501 0.89 MAPT (0.42) ALDH1A1MAPTL3MBTL1KMT2A
SCHEMBL30534545 0.85 ICMT (0.41) ALDH1A1L3MBTL1MEN1KMT2AHTR7
SCHEMBL29036176 0.85 ICMT (0.41) ALDH1A1L3MBTL1MEN1KMT2AHTR7
SCHEMBL29036167 0.83 ICMT (0.40) ALDH1A1MAPTMEN1KMT2AHTR7
SCHEMBL30534506 0.83 ICMT (0.40) ALDH1A1MAPTMEN1KMT2AHTR7
SCHEMBL30534518 0.83 MAPT (0.40) ALDH1A1MAPTL3MBTL1DRD4
SCHEMBL29036159 0.83 MAPT (0.40) ALDH1A1MAPTL3MBTL1DRD4
SCHEMBL29036163 0.81 SLC6A2 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116462686-A 4-aryl (methyl) group-1, 4-benzoxazine imidazoline compound and preparation method and application thereof 湖南科技大学 2023-07-21 CN disclosed