SCHEMBL7449594

SCHEMBL7449594

O=C(O)c1cccc(NC(=O)c2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.84
▸ KMT2A Q03164 8/20 0.84
▸ THRB P10828 1/20 0.71
▸ CASP3 P42574 2/20 0.66
▸ SENP8 Q96LD8 2/20 0.66
▸ SENP7 Q9BQF6 2/20 0.66
▸ SENP6 Q9GZR1 2/20 0.66
▸ LMNA P02545 3/20 0.64
▸ MAPT P10636 3/20 0.64
▸ HTT P42858 2/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ PKM P14618 1/20 0.62
▸ ADORA3 P0DMS8 1/20 0.62
▸ SLC6A3 Q01959 1/20 0.62
▸ PTBP1 P26599 1/20 0.60
▸ HDAC2 Q92769 1/20 0.60
▸ HDAC8 Q9BY41 1/20 0.60
▸ HDAC6 Q9UBN7 1/20 0.60

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
SCHEMBL13532166 0.95 MEN1 (0.76) MEN1KMT2ATHRBCASP3SENP8
SCHEMBL3502755 0.91 MEN1 (1.00) MEN1KMT2ATHRBCASP3SENP8
SCHEMBL27179830 0.91 MEN1 (0.69) MEN1KMT2ATHRBCASP3SENP8
SCHEMBL7366821 0.90 AKR1C3 (0.67) MEN1KMT2ATHRBMAPTSMN1; SMN2
SCHEMBL7449794 0.89 MEN1 (0.67) MEN1KMT2ATHRBCASP3SENP8
SCHEMBL13532197 0.88 MEN1 (0.84) MEN1KMT2ATHRBCASP3SENP8
SCHEMBL7444940 0.87 MEN1 (0.65) MEN1KMT2ATHRBLMNAMAPT
SCHEMBL30926962 0.87 MEN1 (0.66) MEN1KMT2ATHRBLMNAMAPT
SCHEMBL27181037 0.87 MEN1 (0.66) MEN1KMT2ATHRBLMNAMAPT
SCHEMBL30927046 0.85 MEN1 (0.66) MEN1KMT2ALMNAMAPTHTT

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-2001098274-A2 SULPHONAMIDE DERIVATIVES CELLTECH CHIROSCIENCE LIMITED (GB) 2001-12-27 — — WO claimed
WO-2001098274-A2 SULPHONAMIDE DERIVATIVES CELLTECH CHIROSCIENCE LIMITED (GB) 2001-12-27 — — WO disclosed
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