SCHEMBL10534824

SCHEMBL10534824

COc1cc(/N=N/c2ccccc2)c(N=C=O)cc1N=C=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.50
▸ CYP3A4 P08684 3/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ MEN1 O00255 7/20 0.45
▸ KMT2A Q03164 7/20 0.45
▸ MAPT P10636 6/20 0.45
▸ POLB P06746 3/20 0.45
▸ MAPK1 P28482 3/20 0.45
▸ PKM P14618 1/20 0.45
▸ L3MBTL1 Q9Y468 4/20 0.42
▸ GAA P10253 3/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ BLM P54132 1/20 0.41

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
SCHEMBL10534827 1.00 ALDH1A1 (0.50) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL28234547 0.80 CYP3A4 (0.49) ALDH1A1CYP3A4TDP1MEN1KMT2A
SCHEMBL542663 0.79 CYP3A4 (0.68) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL8163649 0.77 CYP3A4 (0.66) ALDH1A1CYP3A4TDP1HPGDMAPT
SCHEMBL6372278 0.75 CYP3A4 (0.63) ALDH1A1CYP3A4TDP1HPGDMAPT
SCHEMBL10531873 0.75 CYP3A4 (0.51) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL10531872 0.75 CYP3A4 (0.51) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL10534865 0.74 CYP3A4 (0.54) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL10534857 0.74 CYP3A4 (0.54) ALDH1A1CYP3A4TDP1HPGDMEN1
SCHEMBL10984238 0.73 ALDH1A1 (0.50) ALDH1A1CYP3A4TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4824824-A COLOR FORMING AROMATIC ISOCYANATES AND IMINE COMPOUNDS MITSUBISHI PAPER MILLS, LTD. (JP) 1989-04-25 — — US disclosed
EP-0101741-B1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-05-20 — — EP disclosed
US-4521793-A Coloring method and color-forming material ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-04 — — US disclosed
EP-0101741-A1 COLORING METHOD AND COLOR-FORMING MATERIAL Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-03-07 — — EP disclosed
US-4318850-A Carboxamide type azomethine pigment ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-03-09 — — US disclosed
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