SCHEMBL30051338

SCHEMBL30051338

N#Cc1c(-c2cccc(Cl)c2)[nH]c(=S)[nH]c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.64
POLB P06746 3/20 0.58
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
GLA P06280 1/20 0.53
GAA P10253 1/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
IDO1 P14902 1/20 0.52
TDO2 P48775 1/20 0.52
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PIM1 P11309 1/20 0.44
ADORA2A P29274 3/20 0.43
ADORA1 P30542 3/20 0.43
ADORA2B P29275 2/20 0.43
HSD11B1 P28845 1/20 0.42
ATM Q13315 2/20 0.41
GRM5 P41594 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
SCHEMBL28477518 1.00 ACMSD (0.64) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL30050428 0.83 ACMSD (0.64) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL28901729 0.83 POLB (0.70) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL29731504 0.83 ACMSD (0.64) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL29731230 0.83 ACMSD (0.67) ACMSDPOLBKDM4EGAAPIM1
SCHEMBL28843348 0.83 ACMSD (0.67) ACMSDPOLBKDM4EGAAPIM1
SCHEMBL28483299 0.83 ACMSD (0.64) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL28481873 0.83 ACMSD (0.64) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL28485599 0.82 POLB (0.73) ACMSDPOLBKDM4EALDH1A1LMNA
SCHEMBL17550131 0.82 POLB (0.72) ACMSDPOLBKDM4EALDH1A1LMNA

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-111961039-B Myricetin derivative containing substituted pyrimidine, preparation method and application thereof 贵州大学 2022-11-08 CN disclosed