Ortho-Phthalaldehyde

Ortho-Phthalaldehyde

SCHEMBL28300091

O=Cc1ccc(C=O)cc1.O=Cc1ccccc1C=O

nearest known ligand 0.77

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.77
KMT2A Q03164 2/20 0.77
MEN1 O00255 1/20 0.77
THRB P10828 1/20 0.77
BLM P54132 1/20 0.77
TDP1 Q9NUW8 1/20 0.77
ALDH1A1 P00352 7/20 0.63
CYP2A6 P11509 4/20 0.63
TSHR P16473 1/20 0.52
TRIM24 O15164 1/20 0.52
TRIM33 Q9UPN9 1/20 0.52
KDM4E B2RXH2 2/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH5A1 P51649 1/20 0.50
ABAT P80404 1/20 0.50
HPGD P15428 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TYR P14679 1/20 0.44
CYP2A13 Q16696 1/20 0.44

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
Ortho-Phthalaldehyde SCHEMBL33393 0.87 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL29412642 0.87 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL4953869 0.87 LMNA (1.00) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL10792496 0.84 LMNA (0.93) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL28379746 0.84 LMNA (0.93) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL6688449 0.84 LMNA (0.93) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL30132880 0.84 LMNA (0.93) LMNAKMT2AMEN1THRBBLM
Benzaldehyde SCHEMBL16279843 0.81 ALDH1A1 (0.93) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL28856421 0.81 LMNA (0.87) LMNAKMT2AMEN1THRBBLM
Ortho-Phthalaldehyde SCHEMBL28529955 0.81 LMNA (0.87) LMNAKMT2AMEN1THRBBLM

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-109879736-A A kind of refining methd of terephthalaldehyde 中国石化扬子石油化工有限公司 2019-06-14 CN disclosed
CN-109879738-A A kind of refining methd of terephthalaldehyde 中国石化扬子石油化工有限公司 2019-06-14 CN disclosed
CN-109879737-A A kind of refining methd of terephthalaldehyde 中国石化扬子石油化工有限公司 2019-06-14 CN disclosed