Acetaldehyde

Acetaldehyde

SCHEMBL28050240

CC=O.COc1nccnc1S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
LMNA P02545 4/20 0.43
HTR6 P50406 3/20 0.43
TSHR P16473 2/20 0.43
CYP2C9 P11712 2/20 0.43
MPO P05164 1/20 0.43
CYP3A4 P08684 1/20 0.43
ESR1 P03372 1/20 0.42
NR1I2 O75469 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CYP2C19 P33261 4/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TXNRD1 Q16881 1/20 0.36
PKM P14618 4/20 0.36
ALDH1A1 P00352 1/20 0.36
AURKA O14965 1/20 0.36
DHFR P00374 1/20 0.36
F2 P00734 1/20 0.35

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
Sulfanilamide SCHEMBL27917543 0.88 KMT2A (0.55) KMT2AMEN1LMNAHTR6TSHR
SCHEMBL28117507 0.73 ESR1 (0.61) KMT2AMEN1LMNAHTR6TSHR
SCHEMBL27923422 0.73 MEN1 (0.51) KMT2AMEN1LMNAHTR6TSHR
SCHEMBL10731094 0.73 CA1 (0.50) KMT2AMEN1PKMAURKA
SCHEMBL28050238 0.71 MEN1 (0.40) KMT2AMEN1LMNAHTR6TSHR
Sulfalene SCHEMBL28404 0.71 MEN1 (1.00) KMT2AMEN1LMNATSHRESR1
Sulfalene SCHEMBL1893333 0.71 MEN1 (1.00) KMT2AMEN1LMNATSHRESR1
Acetaldehyde SCHEMBL4349619 0.68 TSHR (0.50) KMT2AMEN1LMNAHTR6TSHR
Sulfalene SCHEMBL3964512 0.67 MEN1 (0.90) KMT2AMEN1LMNATSHRESR1
Sulfanilamide SCHEMBL28119905 0.67 CA2 (0.52) KMT2AMEN1LMNAHTR6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105283172-B Ophthalmic cleaning agent and method thereof 港大科桥有限公司 2018-06-26 CN disclosed
CN-107226864-A Covalent diabodies and application thereof 宏观基因有限公司 2017-10-03 CN disclosed
CN-104086540-B Preparation method for 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS 安那迪斯药品股份有限公司 2017-04-12 CN disclosed
CN-106432503-A COVALENT DIABODIES AND USES THEREOF 宏观基因有限公司 2017-02-22 CN disclosed
CN-106220734-A Covalent diabodies and application thereof 宏观基因有限公司 2016-12-14 CN disclosed
CN-102905703-B As TLR2 agonist for treating compound (lipopeptid based on cysteine) and the compositions of infection, inflammation, respiratory disorder etc. 诺华股份有限公司 2016-09-28 CN disclosed
CN-102369021-B Covalent diabodies and uses thereof 宏观基因有限公司 2016-09-07 CN disclosed
CN-102666874-B Polypeptide and the using method thereof in the effector function Han Fc district of improvement is shown due to the change of fucosylation degree MACROGENICS, INC. (US) 2016-06-01 CN disclosed
CN-105283172-A Ophthalmic cleaning agent and method thereof VERSITECH LTD 2016-01-27 CN disclosed