SCHEMBL8062191

SCHEMBL8062191

Cc1ccc(S(=O)(=O)N2CCCC2CNC(=O)[C@@]23CCC[C@@]4(C)CC(CC2C4)C3)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.49
PAX8 Q06710 1/20 0.48

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
SCHEMBL8064682 0.93 RAB9A (0.42) RAB9APAX8
SCHEMBL4541154 0.83 RAB9A (0.56) RAB9APAX8
SCHEMBL8064689 0.81 RAB9A (0.43) RAB9APAX8
SCHEMBL4535257 0.80 RAB9A (0.53) RAB9APAX8
SCHEMBL4535339 0.75 ATM (0.47) RAB9APAX8
SCHEMBL21393258 0.74 RAB9A (0.64) RAB9APAX8
SCHEMBL8064827 0.74 TP53 (0.41) RAB9APAX8
SCHEMBL4537477 0.74 NCOA1 (0.53) RAB9APAX8
SCHEMBL4538787 0.73 PSEN1 (0.51) PAX8
SCHEMBL4542333 0.73 PSEN1 (0.51) PAX8

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