SCHEMBL4538172

SCHEMBL4538172

Cc1ccc(S(=O)(=O)N2CCC(CNC(=O)NC34CC5CC(CC(C5)C3)C4)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 17/20 0.58
EPHX2 P34913 16/20 0.58
LMNA P02545 1/20 0.56
GFER P55789 1/20 0.55

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
SCHEMBL4537966 0.94 LMNA (0.57) EPHX1EPHX2LMNAGFER
SCHEMBL4539891 0.89 LMNA (0.65) EPHX1EPHX2LMNA
SCHEMBL8064838 0.89 EPHX1 (0.68) EPHX1EPHX2
SCHEMBL4542200 0.89 LMNA (0.54) EPHX1EPHX2LMNAGFER
SCHEMBL4537354 0.88 EPHX1 (0.63) EPHX1EPHX2
SCHEMBL4542983 0.85 EPHX1 (0.57) EPHX1EPHX2LMNAGFER
SCHEMBL8059951 0.83 EPHX2 (0.60) EPHX1EPHX2
SCHEMBL4535921 0.83 EPHX1 (0.53) EPHX1EPHX2
SCHEMBL4533513 0.83 EPHX2 (0.60) EPHX1EPHX2
SCHEMBL4539041 0.83 LMNA (0.60) EPHX1EPHX2LMNA

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-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO disclosed
WO-2009070497-A1 SEH AND 11 β-HSD1 INHIBITORS AND THEIR USE SMITHKLINE BEECHAM CORPORATION (US) 2009-06-04 WO disclosed