SCHEMBL25420439

SCHEMBL25420439

Cc1ccc(S(=O)(=O)n2cc(I)c3ccncc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.51
KDM4E B2RXH2 1/20 0.45
UBE2N P61088 1/20 0.45
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
CYP19A1 P11511 2/20 0.44
POLB P06746 1/20 0.44
ALDH3A1 P30838 1/20 0.44
HTT P42858 1/20 0.44
NOD1 Q9Y239 1/20 0.44
RAPGEF4 Q8WZA2 2/20 0.40
PDE4A P27815 2/20 0.40
PDE4B Q07343 2/20 0.40
PDE4C Q08493 2/20 0.40
PDE4D Q08499 2/20 0.40
KLK7 P49862 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL30461713 1.00 HTR6 (0.51) HTR6KDM4EUBE2NCA2CA9
SCHEMBL30975059 0.89 HTR6 (0.61) HTR6KDM4EUBE2NCA2CA9
SCHEMBL254249 0.86 HTR6 (0.52) HTR6
SCHEMBL12450003 0.84 HTR6 (0.51) HTR6KDM4EUBE2NCA2CA9
SCHEMBL30461646 0.82 HTR6 (0.61) HTR6KDM4EUBE2NCA2CA9
SCHEMBL25422336 0.82 HTR6 (0.61) HTR6KDM4EUBE2NCA2CA9
SCHEMBL5429439 0.80 KDM4E (0.68) HTR6KDM4EUBE2NCA2CA9
SCHEMBL31315848 0.80 KDM4E (0.49) HTR6KDM4EUBE2NCA2L3MBTL1
SCHEMBL29414758 0.80 KDM4E (0.68) HTR6KDM4EUBE2NCA2CA9
SCHEMBL16608384 0.78 L3MBTL1 (0.44) HTR6KDM4EUBE2NCA2L3MBTL1

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
WO-2023107722-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 WO disclosed
WO-2023107722-A1 COMPOUNDS FOR USE IN TREATING NEUROLOGICAL DISORDERS PROTHENA BIOSCIENCES LIMITED (IE) 2023-06-15 WO disclosed