SCHEMBL28675591

SCHEMBL28675591

CCOC(=O)c1c(C(=O)OCC)n(-c2ccccc2)cc(C(=O)OC)c1=O

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 4/20 0.51
ALDH1A1 P00352 4/20 0.51
LMNA P02545 2/20 0.51
NR4A2 P43354 1/20 0.49
GAA P10253 3/20 0.49
MAPT P10636 2/20 0.49
GABRA2 P47869 3/20 0.45
GABRB2 P47870 3/20 0.45
HPGD P15428 2/20 0.44
HSD17B10 Q99714 1/20 0.44
PDE4D Q08499 1/20 0.44
RECQL P46063 1/20 0.43

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
SCHEMBL28692806 0.94 KDM4E (0.53) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL30745637 0.93 MEN1 (0.55) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL28667978 0.87 MEN1 (0.63) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL28668614 0.84 ALDH1A1 (0.52) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL28666824 0.82 ALDH1A1 (0.47) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL28662099 0.81 HTT (0.44) KMT2AKDM4EALDH1A1LMNAMAPT
SCHEMBL28668611 0.81 LMNA (0.48) KDM4EALDH1A1LMNAGABRB2
SCHEMBL28667333 0.81 GABRA2 (0.50) MEN1KMT2AKDM4EALDH1A1LMNA
SCHEMBL28672754 0.81 GABRA2 (0.50) KMT2AKDM4EALDH1A1LMNAMAPT
SCHEMBL28683580 0.81 MEN1 (0.58) MEN1KMT2AKDM4EALDH1A1LMNA

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-113880757-B Method for synthesizing 4-pyridone and derivatives thereof through continuous flow 云南民族大学 2024-02-06 CN disclosed
CN-113880757-A Method for synthesizing 4-pyridone and derivatives thereof by continuous flow 云南民族大学 2022-01-04 CN disclosed