SCHEMBL30563199

SCHEMBL30563199

CC(=O)Nc1ccc(S(=O)(=O)N2CCN(c3cc(Cl)cc(C(F)(F)F)c3)CC2)cc1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.66
ALDH1A1 P00352 3/20 0.66
KDM4E B2RXH2 2/20 0.66
ATM Q13315 1/20 0.66
KMT2A Q03164 7/20 0.57
MEN1 O00255 6/20 0.57
LMNA P02545 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TSHR P16473 1/20 0.54
USP2 O75604 1/20 0.53
PKM P14618 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
EPHX2 P34913 1/20 0.52
GAA P10253 1/20 0.52
HTT P42858 1/20 0.52
KDM4C Q9H3R0 1/20 0.52
TDP1 Q9NUW8 1/20 0.52

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
SCHEMBL25381894 1.00 MAPT (0.66) MAPTALDH1A1KDM4EATMKMT2A
SCHEMBL23217100 0.86 MAPT (0.70) MAPTALDH1A1KDM4EATMKMT2A
SCHEMBL31252083 0.86 TRPV4 (0.58) MAPTALDH1A1KDM4EKMT2AMEN1
SCHEMBL25380430 0.83 TRPV4 (0.55) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL30005546 0.81 ALDH1A1 (0.64) MAPTALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL25380477 0.81 GCK (0.59) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL31252072 0.81 GCK (0.59) MAPTALDH1A1KMT2AMEN1LMNA
SCHEMBL23217124 0.81 PTPN11 (0.49) MAPTALDH1A1KDM4EATMKMT2A
SCHEMBL23217109 0.81 NAMPT (0.47) MAPTALDH1A1KDM4EATMKMT2A
SCHEMBL23217375 0.80 NAMPT (0.47) MAPTALDH1A1KDM4EATMKMT2A

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-4486453-A1 BENZAMIDE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. Hoffmann-La Roche AG (CH) 2025-01-08 EP disclosed
WO-2023166103-A1 BENZAMIDE COMPOUNDS FOR TREATMENT OF BACTERIAL INFECTIONS F. HOFFMANN-LA ROCHE AG (CH) 2023-09-07 WO disclosed