SCHEMBL27713361

SCHEMBL27713361

O=C(O)CCc1c(Cl)c2ccccc2n1S(=O)(=O)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 4/20 0.52
▸ PPARA Q07869 4/20 0.52
▸ PPARD Q03181 2/20 0.52
▸ AGTR1 P30556 3/20 0.47
▸ PSEN1 P49768 4/20 0.46
▸ PSEN2 P49810 4/20 0.46
▸ APH1B Q8WW43 4/20 0.46
▸ NCSTN Q92542 4/20 0.46
▸ APH1A Q96BI3 4/20 0.46
▸ PSENEN Q9NZ42 4/20 0.46
▸ HTR6 P50406 4/20 0.40
▸ SRC P12931 1/20 0.40
▸ PTGDR Q13258 1/20 0.40
▸ PTGDR2 Q9Y5Y4 1/20 0.40
▸ FABP3 P05413 1/20 0.40
▸ FABP4 P15090 1/20 0.40
▸ FABP5 Q01469 1/20 0.40
▸ AVPR1A P37288 1/20 0.40
▸ PLA2G2A P14555 1/20 0.39
▸ HTR1A P08908 1/20 0.39

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
SCHEMBL4119321 0.76 ACLY (0.51) PPARGPPARAPPARDAGTR1PSEN1
SCHEMBL3527594 0.75 PPARG (0.66) PPARGPPARAPPARDPSEN1PSEN2
SCHEMBL12093313 0.71 HTR6 (0.70) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL1443267 0.71 CA2 (0.43) AGTR1PSEN1PSEN2APH1BNCSTN
SCHEMBL1466410 0.70 PPARG (0.75) PPARGPPARAPPARD
SCHEMBL7378048 0.70 AGTR1 (0.55) AGTR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3033927 0.70 HTR6 (0.71) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL15565794 0.70 AGTR1 (0.48) AGTR1PSEN1PSEN2APH1BNCSTN
SCHEMBL3040501 0.69 IDE (0.55) PPARGPPARAPPARDHTR6PTGDR2
SCHEMBL3523667 0.69 PPARG (0.76) PPARGPPARAPPARD

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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