SCHEMBL30830343

SCHEMBL30830343

CC(C)[Si](Oc1ccc(CN2C(=O)[C@@H](NC(=O)OC(C)(C)C)CSc3cc(F)c(C#N)cc32)cc1)(C(C)C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 4/20 0.36
▸ XIAP P98170 2/20 0.35
▸ TRPA1 O75762 1/20 0.34
▸ KDM4D Q6B0I6 1/20 0.34
▸ AAK1 Q2M2I8 1/20 0.33
▸ NPY1R P25929 1/20 0.33
▸ DPP4 P27487 1/20 0.32
▸ SCN9A Q15858 3/20 0.32
▸ EGLN2 Q96KS0 1/20 0.32
▸ P2RX3 P56373 1/20 0.31
▸ PRKAA2 P54646 1/20 0.31
▸ NSD2 O96028 1/20 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
SCHEMBL29796815 0.88 SRC (0.36) SRCXIAPKDM4DAAK1NPY1R
SCHEMBL26962100 0.88 SRC (0.36) SRCXIAPKDM4DAAK1NPY1R
SCHEMBL26961755 0.88 POLB (0.37) SRCXIAPTRPA1KDM4DAAK1
SCHEMBL29796885 0.88 SRC (0.38) SRCXIAPTRPA1KDM4DAAK1
SCHEMBL26961886 0.88 SRC (0.38) SRCXIAPTRPA1KDM4DAAK1
SCHEMBL26961693 0.88 SRC (0.39) SRCXIAPKDM4DNPY1RSCN9A
SCHEMBL29796974 0.88 SRC (0.39) SRCXIAPKDM4DNPY1RSCN9A
SCHEMBL26962351 0.87 XIAP (0.43) SRCXIAPKDM4DNPY1RSCN9A
SCHEMBL29796966 0.86 SRC (0.39) SRCXIAPKDM4DAAK1NPY1R
SCHEMBL26961924 0.86 SRC (0.39) SRCXIAPKDM4DAAK1NPY1R

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
US-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2026-02-05 — — US disclosed
EP-4568958-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-06-18 — — EP disclosed
WO-2024033388-A1 BICYCLIC TETRAHYDROTHIAZEPINE 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-20260035364-A1 BICYCLIC TETRAHYDROTHIAZEPINE DERIVATIVES SCN1B, SCN2B, SCN11A SRC 1591/4885XIAP 4823/4885TRPA1 857/4885

“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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