SCHEMBL30490272

SCHEMBL30490272

O=C1CO[C@H]2CCN(C(=O)N3CCC4(C3)CN(c3ccc(Cl)c(C(F)(F)F)c3)C4)C[C@H]2N1

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 11/20 0.55
▸ NOTUM Q6P988 1/20 0.45

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
SCHEMBL25436060 1.00 MGLL (0.55) MGLLNOTUM
SCHEMBL23852871 1.00 MGLL (0.55) MGLLNOTUM
SCHEMBL23211793 0.88 MGLL (0.60) MGLLNOTUM
SCHEMBL23211790 0.88 MGLL (0.60) MGLLNOTUM
SCHEMBL25785289 0.87 MGLL (0.55) MGLL
SCHEMBL23853830 0.87 MGLL (0.55) MGLL
SCHEMBL25785295 0.85 MGLL (0.54) MGLL
SCHEMBL23853105 0.85 MGLL (0.54) MGLL
SCHEMBL25785765 0.82 MGLL (0.54) MGLL
SCHEMBL25785797 0.82 MGLL (0.47) MGLL

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
EP-3883936-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-07-12 — — EP claimed
US-12577257-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2026-03-17 — — US disclosed
EP-3883936-B1 NEW HETEROCYCLIC COMPOUNDS HOFFMANN LA ROCHE (CH) 2023-07-12 — — 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-12577257-B2 Heterocyclic compounds H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CBR1, CBR3 MGLL 3086/4885NOTUM 3019/4885

“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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