SCHEMBL8661503

SCHEMBL8661503

CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.CCCCCCCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCCCCCCC.O=S.[Mo+6]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.56
THRB P10828 1/20 0.56
PPARA Q07869 3/20 0.45
PPARG P37231 2/20 0.45
LIPG Q9Y5X9 1/20 0.43
ALOX5 P09917 1/20 0.42
PTGS2 P35354 1/20 0.42
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
BID P55957 3/20 0.38
MCL1 Q07820 3/20 0.38
BCL2L1 Q07817 2/20 0.38
BAK1 Q16611 2/20 0.38
KAT8 Q9H7Z6 2/20 0.38
LTB4R Q15722 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
MEN1 O00255 1/20 0.38
NR1I2 O75469 1/20 0.38
LMNA P02545 1/20 0.38
CHRM2 P08172 1/20 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
SCHEMBL2379852 0.97 THRA (0.55) THRATHRBPPARAPPARGLIPG
SCHEMBL486877 0.96 THRA (0.53) THRATHRBPPARAPPARGLIPG
SCHEMBL2380466 0.94 THRA (0.56) THRATHRBPPARAPPARGLIPG
SCHEMBL4019156 0.94 THRA (0.55) THRATHRBPPARAPPARGLIPG
Zinc Ion SCHEMBL159097 0.94 THRA (0.55) THRATHRBPPARAPPARGLIPG
Zinc Ion SCHEMBL30830367 0.94 THRA (0.55) THRATHRBPPARAPPARGLIPG
Zinc Ion SCHEMBL8037336 0.94 THRA (0.55) THRATHRBPPARAPPARGLIPG
Zinc Ion SCHEMBL162803 0.94 THRA (0.55) THRATHRBPPARAPPARGLIPG
SCHEMBL8666153 0.94 THRA (0.48) THRATHRBPPARAPPARGLIPG
Zinc Ion SCHEMBL9442241 0.94 THRA (0.55) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5854183-A Grease composition for constant-velocity joints NIPPON OIL CO., LTD. (JP) 1998-12-29 US disclosed