SCHEMBL28914736

SCHEMBL28914736

O=Cc1c(O)c(O)c(C=O)c2ccccc12

nearest known ligand 0.82

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 1/20 0.82
ERN1 O75460 6/20 0.55
ALB P02768 2/20 0.46
TRIM24 O15164 1/20 0.42
TRIM33 Q9UPN9 1/20 0.42
THRB P10828 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
LMNA P02545 2/20 0.39
IDO1 P14902 1/20 0.39
BLM P54132 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.38
HSP90AA1 P07900 1/20 0.38
CYP2A6 P11509 1/20 0.38
POLB P06746 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL8576477 0.93 PADI4 (0.79) PADI4ERN1ALBTRIM24TRIM33
SCHEMBL9309021 0.90 PADI4 (1.00) PADI4ERN1ALBTRIM24TRIM33
SCHEMBL11627970 0.87 PADI4 (0.78) PADI4ERN1TRIM24TRIM33THRB
SCHEMBL12426364 0.84 PADI4 (0.82) PADI4ERN1TRIM24TRIM33THRB
SCHEMBL3905191 0.84 PADI4 (0.60) PADI4ERN1ALBTHRBMEN1
SCHEMBL986883 0.83 PADI4 (0.64) PADI4ERN1THRBMEN1KMT2A
SCHEMBL29588097 0.83 PADI4 (0.64) PADI4ERN1THRBMEN1KMT2A
SCHEMBL14877132 0.81 PADI4 (0.63) PADI4ERN1TRIM24TRIM33THRB
SCHEMBL17348544 0.81 S100A4 (0.62) PADI4ERN1MEN1KMT2A
Iodide SCHEMBL9460922 0.80 PADI4 (0.61) PADI4ERN1THRBMEN1KMT2A

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
CN-113072728-B Preparation method for converting amorphous polymer film into crystalline covalent organic framework film 天津大学 2022-12-16 CN claimed
CN-113072728-A Preparation method for converting amorphous polymer film into crystalline covalent organic framework film 天津大学 2021-07-06 CN claimed
CN-115677954-A Covalent organic framework material with air water-collecting performance and preparation method thereof 江南大学 2023-02-03 CN disclosed
CN-113072728-B Preparation method for converting amorphous polymer film into crystalline covalent organic framework film 天津大学 2022-12-16 CN disclosed
CN-113072728-A Preparation method for converting amorphous polymer film into crystalline covalent organic framework film 天津大学 2021-07-06 CN disclosed