SCHEMBL11705248

SCHEMBL11705248

CC(C)OP(=O)(S)SC(C)C.[Cd]

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.39
ACHE P22303 1/20 0.39
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL1531694 0.98 CTSA (0.40) CTSAACHEALDH1A1L3MBTL1
SCHEMBL345421 0.95 CTSA (0.39) CTSAACHEALDH1A1L3MBTL1
SCHEMBL3680796 0.95 CTSA (0.39) CTSAACHEALDH1A1L3MBTL1
SCHEMBL7123460 0.95 CTSA (0.39) CTSAACHEALDH1A1L3MBTL1
SCHEMBL11700965 0.95 CTSA (0.39) CTSAACHEALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL10893617 0.95 CTSA (0.39) CTSAACHEALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL18047232 0.93 CTSA (0.37) CTSAACHE
Putrescine SCHEMBL8199420 0.84 CTSA (0.31) CTSAACHE
SCHEMBL4652435 0.74 CTSA (0.33) CTSAACHE
SCHEMBL1606168 0.72 CTSA (0.43) CTSAACHEALDH1A1L3MBTL1

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-4018604-A METAL DITHIOCARBAMATES-DITHIOPHOSPHINATES TO PREVENT FOGGING HORIZONS INCORPORATED, A DIVISION OF HORIZONS RESEARCH INCORPORATED (US) 1977-04-19 US disclosed