SCHEMBL8060906

SCHEMBL8060906

C=S(=O)(c1ccc(C)cc1)N1CCCC(CNC(=O)NC23CC4CC(CC(C4)C2)C3)C1

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.52
GFER P55789 1/20 0.51
EPHX1 P07099 17/20 0.49
EPHX2 P34913 16/20 0.47

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
SCHEMBL4542200 0.91 LMNA (0.54) LMNAGFEREPHX1EPHX2
SCHEMBL4537966 0.85 LMNA (0.57) LMNAGFEREPHX1EPHX2
SCHEMBL4542593 0.82 EPHX1 (0.50) LMNAEPHX1EPHX2
SCHEMBL4538172 0.81 EPHX1 (0.58) LMNAGFEREPHX1EPHX2
SCHEMBL4540005 0.81 LMNA (0.57) LMNAEPHX1EPHX2
SCHEMBL8060768 0.81 LMNA (0.57) LMNAEPHX1EPHX2
SCHEMBL4542921 0.81 CYP3A4 (0.57) EPHX1EPHX2
SCHEMBL8062904 0.81 EPHX2 (0.59) EPHX1EPHX2
SCHEMBL4537586 0.81 EPHX1 (0.52) LMNAEPHX1EPHX2
SCHEMBL8062507 0.80 EPHX2 (0.53) EPHX1EPHX2

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