SCHEMBL25845872

SCHEMBL25845872

COC(=O)CC1CCc2cc(OCc3cccc4c3OC(F)(F)O4)ccc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.46
FFAR1 O14842 1/20 0.44
SCN3A Q9NY46 2/20 0.42
PPARA Q07869 4/20 0.41
CD274 Q9NZQ7 2/20 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
SCHEMBL25845869 0.92 PPARD (0.45) PPARDFFAR1SCN3APPARACD274
SCHEMBL25846513 0.91 PPARD (0.55) PPARDFFAR1PPARA
SCHEMBL25845431 0.84 PPARD (0.47) PPARDFFAR1PPARA
SCHEMBL25845452 0.84 PPARD (0.47) PPARDFFAR1PPARA
SCHEMBL25845881 0.83 PPARD (0.39) PPARDFFAR1PPARA
SCHEMBL25845572 0.78 PPARD (0.45) PPARDFFAR1SCN3APPARA
SCHEMBL25845461 0.76 PPARG (0.48) PPARDFFAR1PPARA
SCHEMBL25845447 0.76 CD274 (0.43) PPARDFFAR1PPARACD274
SCHEMBL25846116 0.75 PPARD (0.59) PPARDFFAR1PPARA
SCHEMBL25844242 0.75 PPARD (0.59) PPARDFFAR1PPARA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-10-26 US disclosed
US-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-10-26 US disclosed
EP-4212528-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUND AND MEDICAL APPLICATION THEREOF AB Pharma Ltd. (CN) 2023-07-19 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230339919-A1 BENZO OXYGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND MEDICAL APPLICATION THEREOF GPR55, GPR65, GPR4 PPARD 141/4885FFAR1 52/4885SCN3A 2164/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.