SCHEMBL25324985

SCHEMBL25324985

CS(=O)(=O)c1ccccc1COC1CN(C(=O)N2CC3(CC(c4nnc(C5CC5)[nH]4)C3)C2)C1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 2/20 0.41
▸ CDK2 P24941 5/20 0.34
▸ CCNE1 P24864 4/20 0.34
▸ GSK3B P49841 4/20 0.34
▸ NR3C1 P04150 1/20 0.33
▸ F10 P00742 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MGLL Q99685 2/20 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
SCHEMBL25324941 0.84 GPR119 (0.36) FAAH
SCHEMBL25326089 0.84 NR3C1 (0.34) CDK2CCNE1GSK3BNR3C1CYP3A4
SCHEMBL25325310 0.83 GPR119 (0.38) FAAHCYP3A4MGLL
SCHEMBL25327965 0.83 FAAH (0.34) FAAHF10KMT2AMGLL
SCHEMBL25324958 0.77 MGLL (0.49) FAAHMGLL
SCHEMBL25326394 0.77 MGLL (0.36) FAAHMGLL
SCHEMBL25324021 0.77 MGLL (0.38) FAAHMGLL
SCHEMBL25324545 0.76 ENPP2 (0.41) FAAHMGLL
SCHEMBL25323137 0.75 CYP3A4 (0.30) CDK2CCNE1CYP3A4CYP2D6
SCHEMBL25326500 0.73 GPR119 (0.37) 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 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 FAAH 451/4885CDK2 677/4885CCNE1 642/4885

“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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