SCHEMBL6026237

SCHEMBL6026237

CCCC(NNS(=O)(=O)c1cccc(C(F)(F)F)c1)Sc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP8 P22894 1/20 0.46
MMP13 P45452 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
KAT6A Q92794 1/20 0.45
TRPV1 Q8NER1 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
NR3C1 P04150 1/20 0.43
PGR P06401 1/20 0.43
AR P10275 1/20 0.43
ESR2 Q92731 1/20 0.43
GAA P10253 1/20 0.43
PPARG P37231 1/20 0.43
MMP7 P09237 1/20 0.43
SLC1A3 P43003 1/20 0.42

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
SCHEMBL6025782 0.80 GBA1 (0.42) KAT6ATRPV1KMT2AGAAALDH1A1
SCHEMBL6025519 0.79 KMT2A (0.49) CA1CA2MMP1MMP2MMP9
SCHEMBL3661123 0.75 BCL2L1 (0.45) CA1CA2MMP1MMP2MMP9
SCHEMBL6532198 0.74 ALDH1A1 (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL6530533 0.73 ALPL (0.39) NPSR1HTR6
SCHEMBL6026285 0.73 KMT2A (0.47) CA1CA2MMP1MMP2MMP9
SCHEMBL6025629 0.72 TAS1R3 (0.52) NPSR1GAAPPARGTAS1R3TAS1R1
SCHEMBL6531285 0.72 KMT2A (0.46) CA1CA2MMP1MMP2MMP9
SCHEMBL13753685 0.70 CA1 (0.64) CA1CA2MMP1MMP2MMP9
SCHEMBL5183973 0.69 KAT6A (0.56) CA1CA2MMP1MMP2MMP9

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
EP-1685119-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2006-08-02 EP disclosed
WO-2005049594-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2005-06-02 WO disclosed