SCHEMBL4537521

SCHEMBL4537521

Cc1cccc(S(=O)(=O)N2CCC(CNC(=O)NC34CC5CC(CC(C5)C3)C4)C2)c1

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.54
USP2 O75604 1/20 0.54
EPHX2 P34913 18/20 0.52
EPHX1 P07099 16/20 0.52

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
SCHEMBL4542593 0.95 EPHX1 (0.50) LMNAUSP2EPHX2EPHX1
SCHEMBL4540068 0.89 EPHX1 (0.54) LMNAUSP2EPHX2EPHX1
SCHEMBL4537187 0.89 EPHX1 (0.52) LMNAUSP2EPHX2EPHX1
SCHEMBL4537966 0.88 LMNA (0.57) LMNAEPHX2EPHX1
SCHEMBL4539990 0.88 USP2 (0.56) LMNAUSP2EPHX2EPHX1
SCHEMBL4530583 0.87 EPHX2 (0.46) LMNAUSP2EPHX2
SCHEMBL4537257 0.87 LMNA (0.51) LMNAUSP2EPHX2EPHX1
SCHEMBL4540476 0.86 EPHX2 (0.51) LMNAUSP2EPHX2EPHX1
SCHEMBL4536850 0.84 EPHX1 (0.52) LMNAUSP2EPHX2EPHX1
SCHEMBL4542200 0.84 LMNA (0.54) LMNAEPHX2EPHX1

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