SCHEMBL5016505

SCHEMBL5016505

CCCCCCC(N)CCN(C)S(=O)(=O)c1ccc(CNC(=O)c2ccc(Cl)cc2)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.37
MAPK10 P53779 1/20 0.37
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
CA2 P00918 1/20 0.36
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36
CXCR3 P49682 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA9 Q16790 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34

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
SCHEMBL5016503 0.86 MAPK9 (0.39) MAPK9MAPK10THRATHRBCA2
SCHEMBL3545762 0.85 THRA (0.41) MAPK9MAPK10THRATHRBCA2
SCHEMBL11928842 0.78 CA2 (0.37) MAPK9MAPK10THRATHRBCA2
SCHEMBL3545422 0.77 CA2 (0.41) MAPK9MAPK10THRATHRBCA2
SCHEMBL3540537 0.76 KMT2A (0.47) MAPK9MAPK10THRATHRBCA2
SCHEMBL3545261 0.73 MAPK9 (0.39) MAPK9MAPK10BCL2BCL2L1CXCR3
SCHEMBL3547492 0.73 MEN1 (0.54) MAPK9MAPK10CA2BCL2BCL2L1
SCHEMBL3541193 0.72 LSS (0.45) CXCR3MEN1KMT2ARAB9ASMN1; SMN2
SCHEMBL3545420 0.72 MEN1 (0.50) MAPK9MAPK10CA2BCL2BCL2L1
SCHEMBL13998433 0.72 MAPK9 (0.48) MAPK9MAPK10CA2BCL2BCL2L1

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
EP-1409483-B1 ARYLSULFONAMIDE DERIVATIVES AS C-JUN-N-TERMINAL KINASES (JNK'S) INHIBITORS SERONO LAB (CH) 2008-12-31 EP claimed