SCHEMBL30767579

SCHEMBL30767579

CC(C)(C)OC(=O)N[C@H]1CC(F)(F)c2cc(F)c(-c3nnc(C(C)(C)S(C)(=O)=O)o3)cc2N(Cc2ccc(-c3ccc(C(F)(F)F)cc3)cc2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM2 Q00987 1/20 0.33
▸ FPR2 P25090 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.31
▸ AGTR1 P30556 1/20 0.31
▸ AGTR2 P50052 1/20 0.31
▸ P2RY14 Q15391 1/20 0.30
▸ RORC P51449 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
SCHEMBL30767584 1.00 MDM2 (0.33) MDM2FPR2HDAC6AGTR1AGTR2
SCHEMBL30767484 1.00 MDM2 (0.33) MDM2FPR2HDAC6AGTR1AGTR2
SCHEMBL30767535 0.94 FPR2 (0.32) FPR2RORC
SCHEMBL30767447 0.94 FPR2 (0.32) FPR2RORC
SCHEMBL30767430 0.94 FPR2 (0.32) FPR2RORC
SCHEMBL30767620 0.93 F10 (0.32) FPR2
SCHEMBL30767676 0.93 F10 (0.32) FPR2
SCHEMBL30767408 0.93 F10 (0.32) FPR2
SCHEMBL30767553 0.91 — —
SCHEMBL30767493 0.91 KDM4D (0.32) —

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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