SCHEMBL8666153

SCHEMBL8666153

CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.CCCCc1ccccc1OP(=S)([S-])Oc1ccccc1CCCC.O=S.[Mo+6]

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
PPARA Q07869 2/20 0.38
PPARG P37231 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGS2 P35354 1/20 0.38
TAAR1 Q96RJ0 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LIPG Q9Y5X9 1/20 0.35

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
SCHEMBL2381907 0.97 THRA (0.47) THRATHRBPPARAPPARGALOX5
SCHEMBL486862 0.95 THRA (0.46) THRATHRBPPARAPPARGALOX5
SCHEMBL8661503 0.94 THRA (0.56) THRATHRBPPARAPPARGALOX5
SCHEMBL2380344 0.94 THRA (0.48) THRATHRBPPARAPPARGALOX5
SCHEMBL10349367 0.94 THRA (0.47) THRATHRBPPARAPPARGALOX5
SCHEMBL486998 0.93 THRA (0.47) THRATHRBPPARAPPARGALOX5
SCHEMBL2379852 0.91 THRA (0.55) THRATHRBPPARAPPARGALOX5
SCHEMBL486877 0.90 THRA (0.53) THRATHRBPPARAPPARGALOX5
SCHEMBL2380466 0.88 THRA (0.56) THRATHRBPPARAPPARGALOX5
Zinc Ion SCHEMBL8037336 0.88 THRA (0.55) THRATHRBPPARAPPARGALOX5

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