SCHEMBL4537010

SCHEMBL4537010

COc1ccccc1S(=O)(=O)N1CCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)C1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 17/20 0.55
EPHX1 P07099 16/20 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
SCHEMBL4539563 0.88 EPHX2 (0.56) EPHX2EPHX1
SCHEMBL4532833 0.87 KMT2A (0.53) EPHX2EPHX1
SCHEMBL4537539 0.86 EPHX2 (0.56) EPHX2EPHX1
SCHEMBL4537182 0.86 EPHX2 (0.58) EPHX2EPHX1
SCHEMBL4537075 0.84 CYP19A1 (0.53) EPHX2EPHX1
SCHEMBL8062507 0.83 EPHX2 (0.53) EPHX2EPHX1
SCHEMBL4535739 0.83 EPHX2 (0.54) EPHX2EPHX1
SCHEMBL4539990 0.82 USP2 (0.56) EPHX2EPHX1
SCHEMBL8059951 0.82 EPHX2 (0.60) EPHX2EPHX1
SCHEMBL4533513 0.82 EPHX2 (0.60) EPHX2EPHX1

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 3 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 claimed
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