Butanal

Butanal

SCHEMBL28508291

CCCC=O.CCCCN(C)C(CC)(Cc1ccc(C(C)C)cc1)C(=O)c1ccc(N2CCOCC2)cc1

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 5/20 0.39
L3MBTL1 Q9Y468 4/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPK1 P28482 3/20 0.39
TDP1 Q9NUW8 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
ALOX15 P16050 2/20 0.39
ALOX12 P18054 2/20 0.39
KMT2A Q03164 1/20 0.35
HIF1A Q16665 1/20 0.35
FKBP1A P62942 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 1/20 0.34
LRRK2 Q5S007 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL1631744 0.94 ALDH1A1 (0.46) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1631666 0.84 MAPT (0.40) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1629241 0.84 THRA (0.42) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1630676 0.83 ALDH1A1 (0.51) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL18905110 0.81 MAPT (0.39) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL28508292 0.80 ALDH1A1 (0.43) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL28981549 0.80 SMN1; SMN2 (0.39) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1630624 0.80 ALDH1A1 (0.49) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL1630546 0.79 SMN1; SMN2 (0.40) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2
SCHEMBL8900737 0.78 MAPT (0.41) ALDH1A1LMNAMAPTL3MBTL1SMN1; SMN2

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
CN-112650027-A Method for producing substrate for organic EL panel, and negative photosensitive resin composition 东京应化工业株式会社 2021-04-13 CN disclosed
CN-112147841-A Photosensitive composition, cured product, black matrix, black bank, color filter, image display device, and method for producing patterned cured film 东京应化工业株式会社 2020-12-29 CN disclosed