SCHEMBL25326463

SCHEMBL25326463

CS(=O)(=O)c1cc(Cl)ccc1-c1ccc(C2CN(C(=O)N3CC4(CC(c5nnc(C6CC6)[nH]5)C4)C3)C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.41
▸ AVPR1A P37288 7/20 0.35
▸ FASN P49327 6/20 0.34
▸ OXTR P30559 1/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ ENPP2 Q13822 1/20 0.32
▸ ATXN2 Q99700 1/20 0.32
▸ F10 P00742 1/20 0.32
▸ PRKAB2 O43741 1/20 0.32
▸ PRKAG1 P54619 1/20 0.32
▸ PRKAA2 P54646 1/20 0.32
▸ PRKAA1 Q13131 1/20 0.32
▸ PRKAG3 Q9UGI9 1/20 0.32
▸ PRKAG2 Q9UGJ0 1/20 0.32
▸ PRKAB1 Q9Y478 1/20 0.32
▸ PROKR1 Q8TCW9 1/20 0.32

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
SCHEMBL25323033 0.88 MGLL (0.39) MGLLAVPR1AFASNOXTRPTGDR2
SCHEMBL25324932 0.87 MGLL (0.40) MGLLFASNPRKAB2PRKAG1PRKAA2
SCHEMBL27153177 0.84 MGLL (0.40) MGLLFASNPTGDR2ENPP2ATXN2
SCHEMBL30012458 0.83 MGLL (0.36) MGLLAVPR1AOXTRPTGDR2F10
SCHEMBL27141288 0.83 MGLL (0.36) MGLLAVPR1AOXTRPTGDR2F10
SCHEMBL27140316 0.83 TRPV4 (0.39) MGLLPTGDR2F10PROKR1
SCHEMBL30700198 0.82 MGLL (0.42) MGLLFASNPTGDR2F10PRKAB2
SCHEMBL30012546 0.81 TRPV4 (0.38) MGLLPTGDR2
SCHEMBL27140114 0.81 TRPV4 (0.38) MGLLPTGDR2
SCHEMBL27154340 0.81 MGLL (0.36) MGLLPTGDR2F10

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 3523/4885AVPR1A 135/4885FASN 3611/4885

“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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