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SCHEMBL30767572

SCHEMBL30767572

CC(C)(C)OC(=O)NC1CC(F)(F)c2cc(F)c(-c3nnc(C(C)(C)C#N)o3)cc2N(Cc2ccc(-c3ccc(OC(F)(F)F)cn3)cc2)C1=O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 2/20 0.34
▸ CHRM5 P08912 7/20 0.33
▸ P2RX7 Q99572 1/20 0.32
▸ GCGR P47871 6/20 0.31
▸ GIPR P48546 5/20 0.31
▸ ABHD6 Q9BV23 1/20 0.30
▸ DAGLA Q9Y4D2 1/20 0.30
▸ ALOX5AP P20292 1/20 0.30
▸ FEN1 P39748 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
SCHEMBL30767440 1.00 GRM2 (0.34) GRM2CHRM5P2RX7GCGRGIPR
SCHEMBL30767521 1.00 GRM2 (0.34) GRM2CHRM5P2RX7GCGRGIPR
SCHEMBL30767574 1.00 GRM2 (0.34) GRM2CHRM5P2RX7GCGRGIPR
SCHEMBL30767594 0.95 CPB2 (0.32) P2RX7ALOX5APFEN1
SCHEMBL30767587 0.95 CPB2 (0.32) P2RX7ALOX5APFEN1
SCHEMBL30767479 0.95 CPB2 (0.32) P2RX7ALOX5APFEN1
SCHEMBL31665008 0.95 GRM2 (0.33) GRM2CHRM5GCGRGIPR
SCHEMBL30767541 0.93 CNR2 (0.34) ALOX5APFEN1
SCHEMBL30767537 0.93 CNR2 (0.34) ALOX5APFEN1
SCHEMBL30767580 0.93 CNR2 (0.34) ALOX5APFEN1

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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