SCHEMBL27733786

SCHEMBL27733786

C=CC(c1cccc2nc(C)sc12)S(=O)(=O)n1c(C(C)C(=O)O)cc2cc(Cl)ccc21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 7/20 0.39
▸ PPARD Q03181 6/20 0.39
▸ PPARA Q07869 5/20 0.39
▸ ACLY P53396 7/20 0.33
▸ PSEN1 P49768 1/20 0.32
▸ PSEN2 P49810 1/20 0.32
▸ APH1B Q8WW43 1/20 0.32
▸ NCSTN Q92542 1/20 0.32
▸ APH1A Q96BI3 1/20 0.32
▸ PSENEN Q9NZ42 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ FABP4 P15090 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPT P10636 1/20 0.31

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
SCHEMBL27733882 0.90 PPARG (0.38) PPARGPPARDPPARAACLY
SCHEMBL27713371 0.82 PPARG (0.42) PPARGPPARDPPARAACLYPSEN1
SCHEMBL27733728 0.81 NTSR1 (0.36) PPARGPPARDPPARAACLYPSEN1
SCHEMBL28775103 0.80 MEN1 (0.41) PPARGPPARDPPARAACLYPSEN1
SCHEMBL27733784 0.79 PSEN1 (0.42) ACLYPSEN1PSEN2APH1BNCSTN
SCHEMBL27713457 0.78 PSEN1 (0.46) ACLYPSEN1PSEN2APH1BNCSTN
SCHEMBL27733855 0.77 RECQL (0.41) PPARGPPARDPPARAACLYLMNA
SCHEMBL28770843 0.77 PPARG (0.34) PPARGPPARDPPARAACLYPSEN1
SCHEMBL27713686 0.76 PPARG (0.41) PPARGPPARDPPARAACLYPSEN1
SCHEMBL27713338 0.76 PSEN1 (0.40) ACLYPSEN1PSEN2APH1BNCSTN

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
CN-101248044-B Indole compounds FOURNIER LAB SA 2012-05-30 — — CN disclosed
CN-101248044-A Novel indole compounds FOURNIER LAB SA (FR) 2008-08-20 — — CN disclosed
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