SCHEMBL27713459

SCHEMBL27713459

C=CC(c1ccc2nc(C)sc2c1)S(=O)(=O)n1c(C(CC)C(=O)O)cc2cc(C(F)(F)F)ccc21

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 5/20 0.36
▸ PPARD Q03181 4/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ ACP1 P24666 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PPARA Q07869 5/20 0.34
▸ AKR1C3 P42330 2/20 0.33
▸ AKR1C2 P52895 2/20 0.33
▸ DYRK1A Q13627 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CSNK1D P48730 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ RAB9A P51151 1/20 0.32
▸ AKR1A1 P14550 1/20 0.32
▸ AKR1B1 P15121 1/20 0.32

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
SCHEMBL27713509 0.94 AKR1B1 (0.36) PPARGPPARDTP53MAPTPPARA
SCHEMBL27733656 0.90 PPARG (0.36) PPARGPPARDTP53MAPTACP1
SCHEMBL27733811 0.89 DYRK1A (0.49) ACP1DYRK1ACSNK1DRAB9A
SCHEMBL27733680 0.88 PPARG (0.47) PPARGPPARDTP53MAPTMEN1
SCHEMBL28775099 0.88 PPARG (0.43) PPARGPPARDMEN1KMT2APPARA
SCHEMBL27713592 0.85 ALDH1A1 (0.36) PPARGPPARDPPARAAKR1C3AKR1C2
SCHEMBL27713303 0.83 POLB (0.36) PPARGPPARDPPARAAKR1C3AKR1C2
SCHEMBL27733859 0.82 PPARA (0.47) PPARGPPARDTP53PPARARAB9A
SCHEMBL27833814 0.81 PPARG (0.37) PPARGPPARDMEN1CYP2C9KMT2A
SCHEMBL27713321 0.81 SCN4A (0.42) PPARGPPARDACP1KMT2APPARA

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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