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Sugi Predict / Compounds / SCHEMBL30767620

SCHEMBL30767620

SCHEMBL30767620

COc1ccc(-c2ccc(CN3C(=O)[C@@H](NC(=O)OC(C)(C)C)CC(F)(F)c4cc(F)c(-c5nnc(C(C)(C)S(C)(=O)=O)o5)cc43)cc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 1/20 0.32
▸ FPR2 P25090 2/20 0.32
▸ FPR1 P21462 1/20 0.32
▸ CNR1 P21554 2/20 0.32
▸ CNR2 P34972 2/20 0.32
▸ FAAH O00519 1/20 0.32
▸ ABHD6 Q9BV23 1/20 0.32
▸ CYP19A1 P11511 1/20 0.31
▸ XIAP P98170 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
SCHEMBL30767408 1.00 F10 (0.32) F10FPR2FPR1CNR1CNR2
SCHEMBL30767676 1.00 F10 (0.32) F10FPR2FPR1CNR1CNR2
SCHEMBL30767526 0.94 GPR119 (0.31) —
SCHEMBL30767423 0.94 GPR119 (0.31) —
SCHEMBL30767405 0.94 GPR119 (0.31) —
SCHEMBL30767477 0.93 F10 (0.33) F10FPR2FPR1CNR1CNR2
SCHEMBL30767579 0.93 MDM2 (0.33) FPR2
SCHEMBL30767484 0.93 MDM2 (0.33) FPR2
SCHEMBL30767584 0.93 MDM2 (0.33) FPR2
SCHEMBL30767542 0.92 NPY1R (0.33) XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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