SCHEMBL27965950

SCHEMBL27965950

COc1ccc(C=CC(=O)Oc2ccc(I)cc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.66
MEN1 O00255 2/20 0.66
MAPT P10636 1/20 0.66
F3 P13726 2/20 0.62
THRB P10828 1/20 0.60
ATM Q13315 1/20 0.60
GSK3B P49841 2/20 0.58
HDAC3 O15379 2/20 0.57
HDAC1 Q13547 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
BACE1 P56817 1/20 0.54
LMNA P02545 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
HDAC4 P56524 1/20 0.53
HDAC7 Q8WUI4 1/20 0.53
HDAC10 Q969S8 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC9 Q9UKV0 1/20 0.53

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
SCHEMBL18121572 0.92 KMT2A (0.76) KMT2AMEN1MAPTF3THRB
SCHEMBL23084952 0.87 KMT2A (0.54) KMT2AMEN1MAPTF3THRB
SCHEMBL22490432 0.87 KMT2A (0.69) KMT2AMEN1MAPTF3THRB
SCHEMBL7694734 0.85 KMT2A (0.69) KMT2AMEN1MAPTF3THRB
SCHEMBL22005455 0.85 MAPT (0.77) KMT2AMEN1MAPTF3THRB
SCHEMBL7694732 0.85 KMT2A (0.69) KMT2AMEN1MAPTF3THRB
SCHEMBL24929910 0.85 THRB (0.83) KMT2AMEN1MAPTF3THRB
SCHEMBL16968117 0.85 MAPT (0.77) KMT2AMEN1MAPTF3THRB
SCHEMBL14877836 0.85 MAPT (0.77) KMT2AMEN1MAPTF3THRB
SCHEMBL27220249 0.85 KMT2A (0.73) KMT2AMEN1MAPTF3THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111212878-B Liquid crystal aligning agent, liquid crystal alignment film, method for producing same, and liquid crystal element JSR株式会社 2022-06-14 CN disclosed
CN-111212878-A Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal element JSR株式会社 2020-05-29 CN disclosed
CN-103959152-A Method for manufacturing liquid crystal alignment film, liquid crystal alignment film, and liquid crystal display element NISSAN CHEMICAL IND LTD 2014-07-30 CN disclosed