SCHEMBL30767466

SCHEMBL30767466

COC(F)(c1nnc(-c2cc3c(cc2F)C(F)(F)CC(NC(=O)OC(C)(C)C)C(=O)N3Cc2ccc(OC(F)(F)F)cc2)o1)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 1/20 0.32
▸ EDNRB P24530 1/20 0.32
▸ EDNRA P25101 1/20 0.32
▸ CHRM5 P08912 6/20 0.31
▸ GCGR P47871 2/20 0.31
▸ GIPR P48546 2/20 0.31
▸ HCRTR1 O43613 4/20 0.31
▸ HCRTR2 O43614 4/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ PTGDR2 Q9Y5Y4 1/20 0.31
▸ PLAT P00750 1/20 0.30

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
SCHEMBL30767590 1.00 GRM2 (0.32) GRM2EDNRBEDNRACHRM5GCGR
SCHEMBL30767451 1.00 GRM2 (0.32) GRM2EDNRBEDNRACHRM5GCGR
SCHEMBL30767410 0.93 GRM2 (0.34) GRM2EDNRBEDNRACHRM5GCGR
SCHEMBL31665008 0.90 GRM2 (0.33) GRM2CHRM5GCGRGIPRHCRTR1
SCHEMBL30767361 0.87 HCRTR1 (0.34) GRM2EDNRBEDNRACHRM5HCRTR1
SCHEMBL30767601 0.87 HCRTR1 (0.34) GRM2EDNRBEDNRACHRM5HCRTR1
SCHEMBL30767307 0.87 HCRTR1 (0.34) GRM2EDNRBEDNRACHRM5HCRTR1
SCHEMBL30767440 0.86 GRM2 (0.34) GRM2CHRM5GCGRGIPR
SCHEMBL30767521 0.86 GRM2 (0.34) GRM2CHRM5GCGRGIPR
SCHEMBL30767589 0.85 MAPT (0.33) GRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4568960-B1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2026-04-29 — — EP disclosed
US-20250236614-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2025-07-24 — — US disclosed
EP-4568960-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-06-18 — — EP disclosed
WO-2024033458-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-02-15 — — 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-20250236614-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES GRIN2C, CNR1, CNR2 GRM2 283/4885EDNRB 404/4885EDNRA 484/4885

“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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