SCHEMBL18906018

SCHEMBL18906018

Nc1ccc(CNC(=O)c2ccco2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.69
HPGD P15428 2/20 0.69
KMT2A Q03164 3/20 0.62
MEN1 O00255 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.57
PKM P14618 2/20 0.57
CYP1A2 P05177 1/20 0.57
CYP3A4 P08684 1/20 0.57
APEX1 P27695 1/20 0.57
CYP2C19 P33261 1/20 0.57
CTDSP1 Q9GZU7 1/20 0.55
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
MAPT P10636 2/20 0.54
LMNA P02545 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.52
BLM P54132 1/20 0.52
GFER P55789 1/20 0.51
EPHX2 P34913 1/20 0.50

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
SCHEMBL5123738 0.86 ALDH1A1 (0.77) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL18906015 0.84 ALDH1A1 (0.79) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL16266238 0.81 ALDH1A1 (1.00) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL552230 0.81 ALDH1A1 (0.65) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL26644596 0.80 ALDH1A1 (0.68) ALDH1A1HPGDKMT2AMEN1NPC1
SCHEMBL29190985 0.80 ALDH1A1 (0.63) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL7076501 0.79 MAPT (0.68) ALDH1A1HPGDKMT2AMEN1CYP1A2
SCHEMBL7568757 0.79 MAPT (0.53) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL5356496 0.79 KCNK3 (0.61) ALDH1A1HPGDKMT2AMEN1SMN1; SMN2
SCHEMBL2412481 0.79 HDAC1 (0.67) KMT2A

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-20170152443-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT CHI MEI CORPORATION (TW) 2017-06-01 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