SCHEMBL11289157

SCHEMBL11289157

CCCCCCCCCCCCCCCCCCCCSC(=S)SCCCCCCCCCCCCCCCCCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.42
TSHR P16473 2/20 0.42
HSD17B10 Q99714 2/20 0.41
CES2 O00748 2/20 0.41
GMNN O75496 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
BLM P54132 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
LMNA P02545 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACHE P22303 2/20 0.39
MGLL Q99685 1/20 0.39
CA12 O43570 2/20 0.38

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
SCHEMBL35565 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL11170048 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL11441821 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL35803 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL35363 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL10571256 1.00 THRB (0.42) THRBTSHRHSD17B10CES2GMNN
SCHEMBL10569638 0.97 NOS3 (0.44) THRBTSHRHSD17B10CES2GMNN
SCHEMBL1441085 0.97 NOS3 (0.44) THRBTSHRHSD17B10CES2GMNN
SCHEMBL11295295 0.95 THRB (0.39) THRBTSHRHSD17B10CES2GMNN
SCHEMBL14895470 0.95 THRB (0.39) THRBTSHRHSD17B10CES2GMNN

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-4316797-A FROTH FLOTATION USING AN AROMATIC OIL AND ALLYL GUTYL TRITHIOCARBONATE PHILLIPS PETROLEUM COMPANY (US) 1982-02-23 US disclosed