SCHEMBL27145448

SCHEMBL27145448

O=C(N1CC(OCc2ccc(F)cc2C(F)(F)F)C1)N1CC2(CC(n3cnc(C4CC4)n3)C2)C1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 11/20 0.54
▸ GPR183 P32249 1/20 0.34
▸ IDO1 P14902 2/20 0.34
▸ P2RX7 Q99572 3/20 0.34
▸ TTR P02766 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
SCHEMBL27143171 0.90 MGLL (0.49) MGLLIDO1
SCHEMBL27147851 0.86 MGLL (0.53) MGLLIDO1
SCHEMBL27152934 0.86 MGLL (0.54) MGLLGPR183
SCHEMBL30945223 0.85 MGLL (0.57) MGLLGPR183P2RX7
SCHEMBL27144948 0.85 MGLL (0.49) MGLLP2RX7
SCHEMBL27140334 0.83 MGLL (0.52) MGLL
SCHEMBL27149610 0.83 MGLL (0.54) MGLL
SCHEMBL27246524 0.83 MGLL (0.47) MGLL
SCHEMBL27154641 0.81 MGLL (0.48) MGLL
SCHEMBL27246250 0.81 MGLL (0.57) MGLLGPR183P2RX7

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-20240199587-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-06-20 — — US claimed
EP-4326714-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-02-28 — — EP claimed
WO-2022223750-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2022-10-27 — — WO claimed
US-20240199587-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-06-20 — — US disclosed
EP-4326714-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2024-02-28 — — EP disclosed
WO-2022223750-A1 HETEROCYCLIC COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2022-10-27 — — 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-20240199587-A1 HETEROCYCLIC COMPOUNDS CYP1B1, CYP1A1, CYP4B1 MGLL 4524/4885GPR183 1835/4885IDO1 1568/4885

“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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