SCHEMBL27733726

SCHEMBL27733726

C=CC(c1cccc2ccccc12)S(=O)(=O)n1c(C(CC)C(=O)O)cc2cc(Cl)ccc21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 10/20 0.42
▸ PPARA Q07869 6/20 0.42
▸ KDM4E B2RXH2 1/20 0.37
▸ PPARD Q03181 5/20 0.37
▸ ACLY P53396 6/20 0.34
▸ PHGDH O43175 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL27713371 0.88 PPARG (0.42) PPARGPPARAPPARDACLY
SCHEMBL28770822 0.86 RAB9A (0.37) PPARGPPARAKDM4EPPARDMEN1
SCHEMBL27733711 0.85 PPARG (0.41) PPARGPPARAKDM4EPPARDACLY
SCHEMBL27833766 0.83 PHGDH (0.38) PPARGPPARAPPARDACLYPHGDH
SCHEMBL27733882 0.82 PPARG (0.38) PPARGPPARAKDM4EPPARDACLY
SCHEMBL27733852 0.82 PSEN1 (0.39) PPARGPPARAPPARDACLYPHGDH
SCHEMBL28775109 0.82 RECQL (0.39) PPARGPPARAKDM4EPPARDACLY
SCHEMBL27733674 0.77 CYP3A4 (0.34) PPARGPPARAKDM4EPPARDACLY
SCHEMBL28770843 0.77 PPARG (0.34) PPARGPPARAPPARDACLYPHGDH
SCHEMBL27733841 0.77 F7 (0.36) PPARGPPARAPPARDPHGDH

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
Send feedback