SCHEMBL25324952

SCHEMBL25324952

O=C(N1CC(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1)N1CC2(CC(c3nnc(C4CC4)[nH]3)C2)C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 10/20 0.42
▸ LMNA P02545 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ RORC P51449 3/20 0.32
▸ DPP4 P27487 2/20 0.32
▸ DPP7 Q9UHL4 2/20 0.32
▸ PREP P48147 1/20 0.32
▸ SCD5 Q86SK9 1/20 0.31
▸ FASN P49327 2/20 0.31

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
SCHEMBL25327992 0.95 MGLL (0.42) MGLLLMNAMAPK1HTTSMN1; SMN2
SCHEMBL25325378 0.87 CA1 (0.37) FASN
SCHEMBL25324787 0.85 LMNA (0.36) MGLLLMNASMN1; SMN2SCD5
SCHEMBL25324021 0.85 MGLL (0.38) MGLL
SCHEMBL25326558 0.84 NAMPT (0.35) MGLLLMNAHTTFASN
SCHEMBL25325184 0.84 MGLL (0.34) MGLLSCD5FASN
SCHEMBL25326080 0.84 MGLL (0.40) MGLLSMN1; SMN2RORC
SCHEMBL25321679 0.82 MGLL (0.42) MGLLRORCFASN
SCHEMBL25326500 0.81 GPR119 (0.37) MGLLSCD5FASN
SCHEMBL25326455 0.80 MGLL (0.47) MGLLFASN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US claimed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP claimed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO claimed
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 — — US disclosed
EP-4469446-A1 NEW HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-12-04 — — EP disclosed
WO-2023144160-A1 NEW HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2023-08-03 — — WO 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-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 MGLL 3523/4885LMNA 3406/4885MAPK1 2494/4885

“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.

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