SCHEMBL28513440

SCHEMBL28513440

COCn1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
ADORA2B P29275 1/20 0.32
MAPT P10636 2/20 0.31
POLB P06746 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL27837234 0.74 MEN1 (0.33) MEN1KMT2AMAPTALDH1A1
SCHEMBL29112987 0.74 L3MBTL1 (0.50) ADORA2BCYP1A2ALDH1A1
SCHEMBL15906884 0.73 L3MBTL1 (0.45) ALDH1A1
SCHEMBL163183 0.72 MAPT (0.47) MEN1KMT2AADORA2BMAPTPOLB
SCHEMBL13383886 0.71 ADORA2B (0.40) ADORA2BALDH1A1
SCHEMBL8195993 0.70 ALDH1A1 (0.43) MEN1KMT2AADORA2BMAPTCYP1A2
SCHEMBL3285819 0.69
SCHEMBL14485539 0.69 DAO (0.30)
SCHEMBL29283322 0.69 POLB (0.32) POLB
SCHEMBL559878 0.68 MAPT (0.50) MEN1KMT2AADORA2BMAPT

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-109563058-B Isocyanuric acid derivative having 1 substituent containing alkoxy group and method for producing same 日产化学株式会社 2022-06-28 CN disclosed
CN-112313226-A Resist underlayer film forming composition containing reaction product with glycidyl ester compound 日产化学株式会社 2021-02-02 CN disclosed