SCHEMBL28937862

SCHEMBL28937862

Cn1cc(-c2cccc(Cl)c2)c(=O)n(C)c1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.50
GAA P10253 3/20 0.49
MAOA P21397 1/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
EGFR P00533 1/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PGR P06401 1/20 0.43
TRPC5 Q9UL62 1/20 0.43
BRD4 O60885 4/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
IDO1 P14902 1/20 0.42
ERN1 O75460 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ITGB1 P05556 1/20 0.40
ITGA4 P13612 1/20 0.40
ITGB7 P26010 1/20 0.40

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
SCHEMBL28937879 0.81 BRD4 (0.45) MAOBMAOAALDH1A1BRD4ERN1
SCHEMBL28937854 0.81 BRD4 (0.42) MAOBMAOAMEN1KMT2ABRD4
SCHEMBL28937852 0.80 MAPT (0.43) MAOBGAAMAOAKDM4EALDH1A1
SCHEMBL11550337 0.80 BRD4 (0.59) KDM4EALDH1A1BRD4ERN1HSD17B10
SCHEMBL11391596 0.74 GAA (0.50) MAOBGAAMAOAKDM4EALDH1A1
SCHEMBL11431671 0.73 EGFR (0.50) MAOBGAAMAOAKDM4EALDH1A1
SCHEMBL28937848 0.72 SMN1; SMN2 (0.47) GAAKDM4EALDH1A1MEN1KMT2A
SCHEMBL21052803 0.72 BRD4 (0.39) GAAKDM4EALDH1A1BRD4ERN1
SCHEMBL11610416 0.72 GAA (0.55) GAAKDM4EALDH1A1EGFRMEN1
SCHEMBL28937872 0.72 ADORA1 (0.45) KDM4EALDH1A1MEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115611816-A Method for efficiently preparing 5-aryl (hetero) ring modified uracil derivative 中国科学院化学研究所 2023-01-17 CN disclosed