SCHEMBL4477501

SCHEMBL4477501

Nc1ccccc1C(=O)NS(=O)(=O)c1ccsc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
HPGD P15428 2/20 0.46
FLT1 P17948 4/20 0.45
FLT4 P35916 4/20 0.45
KDR P35968 4/20 0.45
ALDH1A1 P00352 4/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
PTGS2 P35354 2/20 0.38
FADS1 O60427 1/20 0.38
CFTR P13569 1/20 0.38

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
SCHEMBL4196234 0.82 KDM4E (0.68) KDM4EHPGDFLT1FLT4KDR
SCHEMBL4457676 0.77 EGFR (0.59) KDM4EHPGDFLT1FLT4KDR
SCHEMBL4465528 0.75 ALDH1A1 (0.49) KDM4EHPGDALDH1A1NPC1RAB9A
SCHEMBL23918989 0.75 CA9 (0.47) KDM4EHPGDFLT1FLT4KDR
SCHEMBL6793445 0.75 MMP2 (0.42) ALDH1A1SMN1; SMN2KMT2AMEN1CA1
SCHEMBL4477897 0.73 FLT1 (0.67) KDM4EFLT1FLT4KDRALDH1A1
SCHEMBL4476657 0.73 HPGD (0.55) KDM4EHPGDFLT1FLT4KDR
SCHEMBL10636104 0.73 ALDH1A1 (0.49) KDM4EHPGDALDH1A1NPC1RAB9A
SCHEMBL2294952 0.73 ALDH1A1 (0.48) KDM4EHPGDALDH1A1NPC1RAB9A
SCHEMBL4202292 0.72 MYC (0.55) KDM4EHPGDALDH1A1NPC1RAB9A

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
WO-2009067607-A2 COMBINATIONS OF PDE4 INHIBITORS AND ANTIPSYCHOTICS FOR THE TREATMENT OF PSYCHOTIC DISORDERS MEMORY PHARMACEUTICALS CORPORATION (US) 2009-05-28 WO disclosed