SCHEMBL11455707

SCHEMBL11455707

CCCCSSc1nccs1

nearest known ligand 0.68

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 14/20 0.68
PDK1 Q15118 1/20 0.55
HTR7 P34969 1/20 0.46
FDPS P14324 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL31199159 0.95 FBP1 (0.66) FBP1PDK1HTR7FDPSL3MBTL1
SCHEMBL11823593 0.89 FBP1 (0.66) FBP1PDK1HTR7FDPS
SCHEMBL11826388 0.89 FBP1 (0.66) FBP1PDK1HTR7FDPS
SCHEMBL11825831 0.87 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11827020 0.87 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11833209 0.87 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11824080 0.87 FBP1 (0.63) FBP1PDK1HTR7FDPS
SCHEMBL11818034 0.85 FBP1 (0.70) FBP1PDK1HTR7FDPS
SCHEMBL11821729 0.82 FBP1 (0.50) FBP1PDK1HTR7FDPS
SCHEMBL422538 0.81 HTR7 (0.62) FBP1PDK1HTR7FDPSL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4130562-A Odorant or flavoring thiazolyl disulphides GIVAUDAN CORPORATION (US) 1978-12-19 US claimed
US-4237290-A ODORANTS, FLAVORINGS; REACTION OF A SULFONIUM SALT AND A MERCAPTAN GIVAUDAN CORPORATION (US) 1980-12-02 US disclosed
US-4188488-A ALKYLIMIDAZOLYL SUBSTITUENTS GIVAUDAN CORPORATION (US) 1980-02-12 US disclosed
US-4170594-A Oxazolyl-alkyl-disulphides as flavorants GIVAUDAN CORPORATION (US) 1979-10-09 US disclosed
US-4130562-A Odorant or flavoring thiazolyl disulphides GIVAUDAN CORPORATION (US) 1978-12-19 US disclosed