SCHEMBL5547718

SCHEMBL5547718

NC(=S)C(N)=S.O=C(O)S.O=C(O)S.O=C(O)S

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
LMNA P02545 2/20 0.36
TSHR P16473 1/20 0.36
ATM Q13315 1/20 0.36
ATR Q13535 1/20 0.36
ALDH1A1 P00352 1/20 0.36
OR51E2 Q9H255 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CYP1A2 P05177 1/20 0.32
TAS2R38 P59533 1/20 0.32
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31

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
Carbamic Acid SCHEMBL10800777 0.80
Carbamic Acid SCHEMBL28116786 0.80
Carbamic Acid SCHEMBL5903960 0.79
Carbonotrithioic Acid SCHEMBL28112049 0.79
Carbonotrithioic Acid SCHEMBL5547722 0.79 CA1 (0.60) TSHRATMATRALDH1A1CA1
SCHEMBL4783424 0.75
Urea SCHEMBL27396613 0.75
SCHEMBL11146863 0.75 ALDH1A1 (0.42) ACHELDHALDHBLMNATSHR
Carbamic Acid SCHEMBL28193333 0.74 ACHE (0.50) ACHELDHALDHBLMNATSHR
Oxamate SCHEMBL27517874 0.74 LDHA (0.64) ACHELDHALDHBLMNATSHR

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
JP-2007291363-A METHOD FOR FORMING FILM OF NANOPARTICLES LINKED TO EACH OTHER USING POLYFUNCTIONAL LINKER SONY DEUTSCHE GMBH 2007-11-08 JP disclosed