SCHEMBL11145779

SCHEMBL11145779

CCP(=O)(O)SC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
PKM P14618 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
FDPS P14324 3/20 0.32
KDM4E B2RXH2 1/20 0.32
MMP2 P08253 1/20 0.32
THRB P10828 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
GRM4 Q14833 1/20 0.31
GABBR2 O75899 1/20 0.30
GABBR1 Q9UBS5 1/20 0.30

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
SCHEMBL2428727 0.71
SCHEMBL10706818 0.71 LMNA (0.40) LMNAFDPSGRM4
SCHEMBL11062352 0.68 ALPG (0.31) ALDH1A1TSHRHSD17B10
SCHEMBL11062342 0.68
SCHEMBL9462641 0.68 TP53 (0.31)
SCHEMBL6110820 0.67
SCHEMBL8625628 0.65
SCHEMBL10621075 0.63
SCHEMBL2406587 0.63
SCHEMBL35435 0.62

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
US-4391760-A S-(Tertiary alkyl) alkylphosphonothioic halides RHONE-POULENC AGROCHIMIE (FR) 1983-07-05 US disclosed