SCHEMBL31199159

SCHEMBL31199159

CCCCCSSc1nccs1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 14/20 0.66
PDK1 Q15118 1/20 0.53
HTR7 P34969 1/20 0.45
FDPS P14324 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GPR84 Q9NQS5 1/20 0.33

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
SCHEMBL11455707 0.95 FBP1 (0.68) FBP1PDK1HTR7FDPSL3MBTL1
SCHEMBL11826388 0.91 FBP1 (0.66) FBP1PDK1HTR7FDPS
SCHEMBL11833209 0.89 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11827020 0.89 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11825831 0.89 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11824080 0.89 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11823593 0.87 FBP1 (0.66) FBP1PDK1HTR7FDPS
SCHEMBL11821729 0.86 FBP1 (0.50) FBP1PDK1HTR7FDPSGPR84
SCHEMBL11818034 0.83 FBP1 (0.70) FBP1PDK1HTR7FDPS
SCHEMBL11829570 0.81 FBP1 (0.54) FBP1PDK1HTR7FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118955342-A Disulfide compound and application thereof in preparation of medicines for preventing and/or treating bacterial diseases 华南农业大学 2024-11-15 CN disclosed