SCHEMBL30349752

SCHEMBL30349752

Cc1ccc(S(=O)(=O)n2cc(C(C)C)c3nc(Cc4c(C)cc(OC(N)=O)cc4C)ccc32)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 1/20 0.34
HTR6 P50406 4/20 0.33
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
KMT2A Q03164 5/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 1/20 0.32
GAA P10253 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KDM1A O60341 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL22632905 0.86 ALK (0.40) ALKHTR6PDE4APDE4BPDE4C
SCHEMBL22632544 0.86 ALK (0.36) ALKHTR6PDE4APDE4BPDE4C
SCHEMBL22632943 0.84 HTR6 (0.34) ALKHTR6SLC1A3SLC1A2SLC1A1
SCHEMBL29414834 0.84 HTR6 (0.34) ALKHTR6SLC1A3SLC1A2SLC1A1
SCHEMBL22632661 0.84 ALK (0.36) ALKHTR6PDE4APDE4BPDE4C
SCHEMBL29414674 0.83 CD4 (0.42) ALKHTR6HTTCYP19A1
SCHEMBL22632610 0.83 CD4 (0.42) ALKHTR6HTTCYP19A1
SCHEMBL29414672 0.83 CD4 (0.42) ALKHTR6HTTCYP19A1
SCHEMBL31405774 0.82 HTR6 (0.36) ALKHTR6PDE4APDE4BPDE4C
SCHEMBL30349385 0.82 ALK (0.38) ALKHTR6PDE4APDE4BPDE4C

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
EP-4178672-A1 MODULATORS OF THR-ß AND METHODS OF USE THEREOF Aligos Therapeutics, Inc. (US) 2023-05-17 EP disclosed