SCHEMBL4535259

SCHEMBL4535259

Cc1ccc(S(=O)(=O)N2CCCCC2CNC(=O)[C]2CCCCCCC2)cc1.[CH2].[CH2]

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.55
PAX8 Q06710 1/20 0.55
NCOA1 Q15788 1/20 0.49
NCOA3 Q9Y6Q9 1/20 0.49
ALDH1A1 P00352 1/20 0.48
GAA P10253 1/20 0.48
TP53 P04637 1/20 0.47
TSHR P16473 1/20 0.47
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46

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
SCHEMBL4541156 0.97 RAB9A (0.58) RAB9APAX8
SCHEMBL4535937 0.89 PSEN1 (0.58) RAB9APAX8ALDH1A1PSEN1PSEN2
SCHEMBL4536845 0.89 RAB9A (0.52) RAB9ATSHR
SCHEMBL4539055 0.89 RAB9A (0.46) RAB9APAX8TP53TSHRPSEN1
SCHEMBL4537566 0.89 RAB9A (0.57) RAB9AALDH1A1
SCHEMBL4534822 0.88 MEN1 (0.52) RAB9APAX8ALDH1A1TSHR
SCHEMBL4536852 0.88 HTR1A (0.52) RAB9A
SCHEMBL4537480 0.86 NCOA1 (0.54) RAB9APAX8NCOA1NCOA3GAA
SCHEMBL4538792 0.86 PSEN1 (0.53) RAB9APAX8PSEN1PSEN2APH1B
SCHEMBL4542334 0.86 PSEN1 (0.53) RAB9APAX8PSEN1PSEN2APH1B

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