SCHEMBL9650772

SCHEMBL9650772

CCCCCCCc1ccccc1OC(N)=S.NC(O)=S

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.57
THRB P10828 1/20 0.57
PPARA Q07869 3/20 0.49
PPARG P37231 2/20 0.49
LIPG Q9Y5X9 1/20 0.47
ALOX5 P09917 1/20 0.47
PTGS2 P35354 1/20 0.47
BID P55957 3/20 0.41
MCL1 Q07820 3/20 0.41
BCL2L1 Q07817 2/20 0.41
BAK1 Q16611 2/20 0.41
KAT8 Q9H7Z6 2/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
MAPT P10636 1/20 0.41
OPRK1 P41145 1/20 0.41

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
SCHEMBL4407225 1.00 THRA (0.57) THRATHRBPPARAPPARGLIPG
SCHEMBL1606187 0.99 THRA (0.56) THRATHRBPPARAPPARGLIPG
SCHEMBL28415892 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28422512 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28413250 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28418186 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28416770 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28413252 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL28416774 0.97 THRA (0.59) THRATHRBPPARAPPARGLIPG
SCHEMBL15174104 0.95 THRA (0.57) THRATHRBPPARAPPARGLIPG

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
EP-0291521-B1 SULFUR-CONTAINING COMPOSITIONS, LUBRICANT, FUEL AND FUNCTIONAL FLUID COMPOSITIONS The Lubrizol Corporation (US) 1992-12-30 EP disclosed
US-5141658-A Extreme pressure lubricant; oxidation, wear, corrosion resistance UNIVERSITY OF QUEENSLAND 1992-08-25 US disclosed
EP-0448129-A2 Sulfur-containing compositions, lubricant fuel and functional fluid compositions The Lubrizol Corporation (US) 1991-09-25 EP disclosed
EP-0291521-A1 SULFUR-CONTAINING COMPOSITIONS, LUBRICANT, FUEL AND FUNCTIONAL FLUID COMPOSITIONS. LUBRIZOL CORP (US) 1988-11-23 EP disclosed
WO-1988003552-A2 SULFUR-CONTAINING COMPOSITIONS, LUBRICANT, FUEL AND FUNCTIONAL FLUID COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1988-05-19 WO disclosed