SCHEMBL9114934

SCHEMBL9114934

Cc1ccc(S(=O)(=O)N(C(=O)OC(C)(C)C)[C@H]2CCCC[C@@H]2N)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT5B P51692 2/20 0.39
STAT3 P40763 1/20 0.39
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 4/20 0.36
MAPK1 P28482 2/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
POLB P06746 1/20 0.36
ENPP3 O14638 2/20 0.36
ENPP1 P22413 2/20 0.36
ENPP2 Q13822 2/20 0.36
F2 P00734 1/20 0.36
TAS2R14 Q9NYV8 2/20 0.35
NR1D1 P20393 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
MMP13 P45452 1/20 0.35

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
SCHEMBL4367433 1.00 STAT5B (0.39) STAT5BSTAT3ALDH1A1MEN1KMT2A
SCHEMBL30689711 0.81 ALDH1A1 (0.36) STAT5BSTAT3ALDH1A1MEN1KMT2A
SCHEMBL28010137 0.76 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2TP53
SCHEMBL810837 0.74 HTR2A (0.51) ALDH1A1MEN1KMT2ASMN1; SMN2NPSR1
SCHEMBL30689733 0.73 NR1D1 (0.35) STAT5BSTAT3MEN1KMT2ATP53
SCHEMBL30865701 0.73 JAK2 (0.35) STAT5BSTAT3MEN1KMT2AL3MBTL1
SCHEMBL2960697 0.72 AGER (0.45) STAT5BALDH1A1MEN1KMT2ATP53
SCHEMBL1864283 0.71 ALDH1A1 (0.51) STAT5BALDH1A1F2NR1D1LMNA
SCHEMBL17507932 0.70 HSD11B1 (0.35)
SCHEMBL5903172 0.70 HSD11B1 (0.35)

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-1995028968-A1 DIAGNOSTIC IMAGE ANALYSIS WITH METAL COMPLEXES MONSANTO COMPANY (US) 1995-11-02 WO disclosed