SCHEMBL25845861

SCHEMBL25845861

COC(=O)CC1CCc2cc(OCc3cc(NC(=O)OC(C)(C)C)cc4c3OCO4)ccc21

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.40
PPARA Q07869 7/20 0.39
PPARG P37231 1/20 0.39
FFAR1 O14842 1/20 0.38

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
SCHEMBL25846501 0.93 PPARD (0.47) PPARDPPARAPPARGFFAR1
SCHEMBL25845881 0.88 PPARD (0.39) PPARDPPARAFFAR1
SCHEMBL25845680 0.87 FFAR1 (0.42) PPARDPPARAPPARGFFAR1
SCHEMBL25845682 0.87 FFAR1 (0.42) PPARDPPARAPPARGFFAR1
SCHEMBL25845572 0.83 PPARD (0.45) PPARDPPARAPPARGFFAR1
SCHEMBL25846544 0.82 PPARD (0.45) PPARDPPARAFFAR1
SCHEMBL25846371 0.80 FFAR1 (0.51) PPARDPPARAPPARGFFAR1
SCHEMBL25844258 0.80 FFAR1 (0.51) PPARDPPARAPPARGFFAR1
SCHEMBL25845717 0.79 FFAR1 (0.43) PPARDPPARAPPARGFFAR1
SCHEMBL25845756 0.77 FFAR1 (0.43) PPARDPPARAPPARGFFAR1

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-4212528-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUND AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-07-19 EP disclosed