SCHEMBL1203288

SCHEMBL1203288

Cc1ccc(S(=O)(=O)n2cc([SnH3])c3ccccc32)cc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.68
UBE2N P61088 1/20 0.68
L3MBTL1 Q9Y468 2/20 0.66
HTR6 P50406 8/20 0.61
ALOX5 P09917 3/20 0.54
ALK Q9UM73 1/20 0.54
LMNA P02545 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
CYP19A1 P11511 2/20 0.53
KLK7 P49862 1/20 0.53
PTGS2 P35354 1/20 0.52
POLB P06746 1/20 0.51
ALDH3A1 P30838 1/20 0.51
HTT P42858 1/20 0.51
NOD1 Q9Y239 1/20 0.51
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL3615171 0.84 HTR6 (0.78) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL22339784 0.84 KDM4E (0.66) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL29414758 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL3615167 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL28018212 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL29460860 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL5429439 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL517434 0.82 KDM4E (0.68) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL949348 0.81 LMNA (0.82) KDM4EUBE2NL3MBTL1HTR6ALOX5
SCHEMBL29694480 0.81 KDM4E (1.00) KDM4EUBE2NL3MBTL1HTR6ALOX5

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
US-20110027817-A1 TAU PROTEIN SCREENING ASSAY ARANCIO OTTAVIO 2011-02-03 US disclosed
WO-2009033151-A1 TAU PROTEIN SCREENING ASSAY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-03-12 WO disclosed