SCHEMBL8056217

SCHEMBL8056217

CCCCc1ccc(Oc2ccc(CCCC)cc2CCCC)c(CCCC)c1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.50
MAPT P10636 3/20 0.50
MAPK1 P28482 2/20 0.50
APAF1 O14727 2/20 0.50
THRB P10828 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RAD52 P43351 2/20 0.49
NPC1 O15118 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
SKP2 Q13309 1/20 0.46
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
BLM P54132 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL11537528 0.92 HTT (0.45) HTTMAPTMAPK1APAF1THRB
SCHEMBL6367936 0.87 ALOX5 (0.50) HTTMAPTMAPK1APAF1THRB
SCHEMBL29366175 0.85 HTT (0.50) HTTMAPTMAPK1APAF1THRB
SCHEMBL125443 0.85 HTT (0.50) HTTMAPTMAPK1APAF1THRB
SCHEMBL6367931 0.85 HTT (0.48) HTTMAPTMAPK1APAF1THRB
SCHEMBL340172 0.85 HTT (0.48) HTTMAPTMAPK1APAF1THRB
SCHEMBL18934130 0.82 HTT (0.46) HTTMAPTMAPK1APAF1THRB
SCHEMBL9240277 0.82
SCHEMBL9070266 0.81 PPARG (0.55) HTTMAPTMAPK1APAF1THRB
SCHEMBL3489144 0.81 HTT (0.45) HTTMAPTMAPK1APAF1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0285608-B2 WATER-IN-OIL EMULSIONS LUBRIZOL CORP (US) 2000-05-17 EP disclosed
EP-0333754-B1 EXPLOSIVE COMPOSITIONS LUBRIZOL CORP (US) 1995-07-26 EP disclosed
EP-0285608-B1 WATER-IN-OIL EMULSIONS The Lubrizol Corporation (US) 1990-08-01 EP disclosed
EP-0364511-A1 WATER-IN-OIL EMULSIONS The Lubrizol Corporation (US) 1990-04-25 EP disclosed
EP-0116399-B1 DITHIOPHOSPHORUS/AMINE SALTS AND AQUEOUS COMPOSITIONS CONTAINING SAME The Lubrizol Corporation (US) 1990-03-14 EP disclosed
EP-0333754-A1 EXPLOSIVE COMPOSITIONS. LUBRIZOL CORP (US) 1989-09-27 EP disclosed
US-4846985-A HYDROXYSULFIDE OR SECONDARY AMINE COMPOUND THE LUBRIZOL CORPORATION (US) 1989-07-11 US disclosed
US-4844756-A SALT DERIVED FROM HYDROCARBYL-SUBSTITUTED CARBOXYLIC ACID OR ANHYDRIDE OR DERIVATIVE, AND AMMONIA, AN AMINE, OR ALKALI OR ALKALINE EARTH METAL THE LUBRIZOL CORPORATION (US) 1989-07-04 US disclosed
WO-1989005848-A1 WATER-IN-OIL EMULSIONS THE LUBRIZOL CORPORATION (US) 1989-06-29 WO disclosed
US-4840687-A OXIDIZER, REACTION PRODUCT OF A CARBOXYLIC ACLATING AGENT, A POLYAMINE AND AN ACID OR ACID-PRODUCING COMPOUND THE LUBRIZOL CORPORATION (US) 1989-06-20 US disclosed
EP-0285608-A1 WATER-IN-OIL EMULSIONS. LUBRIZOL CORP (US) 1988-10-12 EP disclosed
US-4774351-A EXTREME PRESSURE LUBRICANTS, WEAR RESISTANCE THE LUBRIZOL CORPORATION (US) 1988-09-27 US disclosed
WO-1988003522-A1 EXPLOSIVE COMPOSITIONS THE LUBRIZOL CORPORATION (US) 1988-05-19 WO disclosed
US-4721802-A EXTREME PRESSURE LUBRICANTS THE LUBRIZOL CORPORATION (US) 1988-01-26 US disclosed
US-4708753-A NITROGEN CONTAINING SALT EMULSIFIERS; HYDRAULIC FLUIDS, EXPLOSIVES, ACIDIZING FLUIDS THE LUBRIZOL CORPORATION (US) 1987-11-24 US disclosed
WO-1987003613-A2 WATER-IN-OIL EMULSIONS THE LUBRIZOL CORPORATION (US) 1987-06-18 WO disclosed
EP-0116399-A2 Dithiophosphorus/amine salts and aqueous compositions containing same The Lubrizol Corporation (US) 1984-08-22 EP disclosed