SCHEMBL19217795

SCHEMBL19217795

CCC(=O)OC(COc1ccc(CC2SC(=O)N(C)C2=O)cc1)c1cccc(OC)c1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 11/20 0.53
▸ FFAR1 O14842 4/20 0.47
▸ MPC2 O95563 1/20 0.44
▸ CYP2C8 P10632 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ MCL1 Q07820 1/20 0.34

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
SCHEMBL19559787 0.91 PPARG (0.50) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL6928538 0.86 PPARG (0.72) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL6928116 0.86 PPARG (0.72) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL14213631 0.83 PPARG (0.51) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL14213648 0.83 PPARG (0.51) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL19559701 0.82 PPARG (0.51) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL19559731 0.77 PPARG (0.57) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL6930193 0.77 PPARG (0.69) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL15811536 0.77 PPARG (0.69) PPARGFFAR1MPC2CYP2C8CYP2C9
SCHEMBL6930317 0.77 PPARG (0.69) PPARGFFAR1MPC2CYP2C8CYP2C9

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
EP-3202401-A1 PPAR-SPARING THIAZOLIDINEDIONES AND COMBINATIONS FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES Octeta Therapeutics, LLC (US) 2017-08-09 — — EP disclosed
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