SCHEMBL7085183

SCHEMBL7085183

CCCCc1ccccc1C(=S)S

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.44
CYP3A4 P08684 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TYR P14679 1/20 0.38
FOLH1 Q04609 1/20 0.38
TSHR P16473 4/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
ALOX5 P09917 1/20 0.37
PTGS2 P35354 1/20 0.37
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
TLR8 Q9NR97 1/20 0.36
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
BID P55957 1/20 0.35
BCL2L1 Q07817 1/20 0.35
MCL1 Q07820 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
SCHEMBL7997409 0.93 LIPG (0.54) LIPGCYP3A4TYRTSHRHTT
SCHEMBL11532380 0.93 LIPG (0.54) LIPGCYP3A4TYRTSHRHTT
SCHEMBL11533404 0.93 LIPG (0.54) LIPGCYP3A4TYRTSHRHTT
SCHEMBL11533458 0.93 LIPG (0.54) LIPGCYP3A4TYRTSHRHTT
SCHEMBL11534276 0.93 LIPG (0.54) LIPGCYP3A4TYRTSHRHTT
SCHEMBL28293863 0.89 FOLH1 (0.40) LIPGFOLH1HTTTP53LMNA
SCHEMBL9791249 0.83 LIPG (0.46) LIPGCYP3A4CYP2D6CYP2C9TYR
SCHEMBL1901916 0.81 FOLH1 (0.46) LIPGCYP3A4CYP2D6CYP2C9FOLH1
SCHEMBL4768903 0.81 LIPG (0.44) LIPGCYP3A4CYP2D6CYP2C9TYR
SCHEMBL166286 0.80 GABRA1 (0.43) FOLH1TSHRHTTTP53ALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003072676-A1 ADDITIVE COMPOSITIONS FOR COOLING SYSTEMS DOBER CHEMICAL CORPORATION (US) 2003-09-04 WO disclosed
EP-0580587-B1 SMOKE REDUCING ADDITIVES FOR TWO-CYCLE ENGINE LUBRICANT-FUEL MIXTURE EXXON RESEARCH ENGINEERING CO (US) 1997-05-21 EP disclosed
EP-0580587-A4 SMOKE REDUCING ADDITIVES FOR TWO-CYCLE ENGINE LUBRICANT-FUEL MIXTURE. EXXON RESEARCH ENGINEERING CO (US) 1995-02-22 EP disclosed
EP-0580587-A1 SMOKE REDUCING ADDITIVES FOR TWO-CYCLE ENGINE LUBRICANT-FUEL MIXTURE. EXXON RESEARCH ENGINEERING CO (US) 1994-02-02 EP disclosed
US-5266226-A Ashless lube additives containing complexes of alkoxylated amine, dithiobenzoic acid and adenine (PNE-639) EXXON RESEARCH & ENGINEERING COMPANY (US) 1993-11-30 US disclosed
WO-1993012211-A1 LUBRICATING OIL CONTAINING ASHLESS NON-PHOSPHORUS ADDITIVE EXXON RESEARCH AND ENGINEERING COMPANY (US) 1993-06-24 WO disclosed
WO-1992012224-A1 SMOKE REDUCING ADDITIVES FOR TWO-CYCLE ENGINE LUBRICANT-FUEL MIXTURE EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-07-23 WO disclosed
US-5108462-A Amine salt and-or amide of (thio)benzoic acid derivative EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-04-28 US disclosed
US-5094666-A Ethylene polymer, amine salt or amide of carboxylic or dithiocarboxylic acid EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-03-10 US disclosed
EP-0465042-A1 Composition for improving cold flow properties of middle distillates EXXON RESEARCH AND ENGINEERING COMPANY (US) 1992-01-08 EP disclosed
US-5076945-A Hydrocarbyl substituted amine salts of acid or dithioacid EXXON RESEARCH AND ENGINEERING COMPANY (US) 1991-12-31 US disclosed