SCHEMBL25845699

SCHEMBL25845699

COC(=O)CC1COc2cc(OCc3cc(NC(=O)OC(C)(C)C)cc4c3OC(F)(F)O4)ccc21

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 18/20 0.40
PPARD Q03181 12/20 0.40
PPARG P37231 7/20 0.40

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
SCHEMBL25845701 1.00 FFAR1 (0.40) FFAR1PPARDPPARG
SCHEMBL25844262 0.94 FFAR1 (0.47) FFAR1PPARDPPARG
SCHEMBL25845680 0.89 FFAR1 (0.42) FFAR1PPARDPPARG
SCHEMBL25845682 0.89 FFAR1 (0.42) FFAR1PPARDPPARG
SCHEMBL25845881 0.87 PPARD (0.39) FFAR1PPARD
SCHEMBL25845800 0.84 FFAR1 (0.46) FFAR1PPARDPPARG
SCHEMBL25845789 0.84 FFAR1 (0.48) FFAR1PPARDPPARG
SCHEMBL25845489 0.84 FFAR1 (0.47) FFAR1PPARDPPARG
SCHEMBL25845806 0.84 FFAR1 (0.47) FFAR1PPARDPPARG
SCHEMBL25845468 0.84 FFAR1 (0.46) FFAR1PPARDPPARG

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