SCHEMBL31165481

SCHEMBL31165481

CC(C)(C)OC(=O)N1CCN(S(=O)(=O)c2ccc(Br)c(F)c2)CC1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 12/20 0.56
F13A1 P00488 9/20 0.56
TGM1 P22735 6/20 0.54
PKM P14618 1/20 0.51
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
GPR119 Q8TDV5 3/20 0.48

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
SCHEMBL2378926 1.00 TGM2 (0.56) TGM2F13A1TGM1PKMKMT2A
SCHEMBL14490217 0.96 TGM2 (0.53) TGM2F13A1TGM1PKMKMT2A
SCHEMBL2376710 0.87 ABL1 (0.59) TGM2F13A1TGM1KMT2AMEN1
SCHEMBL5436795 0.86 TGM2 (0.54) TGM2F13A1TGM1PKMGPR119
SCHEMBL5440864 0.83 TGM2 (0.57) TGM2F13A1TGM1PKMKMT2A
SCHEMBL14490221 0.83 ABL1 (0.55) TGM2F13A1TGM1PKMKMT2A
SCHEMBL18498875 0.83 TGM2 (0.53) TGM2F13A1TGM1MAPTGPR119
SCHEMBL6939462 0.83 CYP3A4 (0.62) TGM2F13A1TGM1PKMKMT2A
SCHEMBL23620929 0.83 TGM2 (0.62) TGM2F13A1TGM1PKMGPR119
SCHEMBL30307817 0.83 TGM2 (0.62) TGM2F13A1TGM1PKMGPR119

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-4695259-A1 TRICYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. Hoffmann-La Roche AG (CH) 2026-02-18 EP disclosed
WO-2024213610-A1 TRICYCLIC COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. HOFFMANN-LA ROCHE AG (CH) 2024-10-17 WO disclosed