SCHEMBL8053080

SCHEMBL8053080

CCCCCCCCc1cc(CCCCCCCC)cc(Oc2cc(CCCCCCCC)cc(CCCCCCCC)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 5/20 0.55
FUT7 Q11130 1/20 0.54
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
CYP3A4 P08684 2/20 0.52
GPR84 Q9NQS5 2/20 0.50
ESR1 P03372 2/20 0.45
ADRA2A P08913 2/20 0.45
ADORA3 P0DMS8 2/20 0.45
TACR2 P21452 2/20 0.45
SLC6A2 P23975 2/20 0.45
SLC6A4 P31645 2/20 0.45
SLC6A3 Q01959 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
SHBG P04278 1/20 0.45
TP53 P04637 1/20 0.45
HSPD1 P10809 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
SCHEMBL27672312 0.89 PTGS2 (0.50) PTGS2FUT7CA1CA2CA9
SCHEMBL8560359 0.86 PTGS2 (0.70) PTGS2FUT7CYP3A4GPR84ESR1
SCHEMBL7628223 0.86 PTGS2 (0.70) PTGS2FUT7CYP3A4GPR84ESR1
SCHEMBL9122379 0.86 PTGS2 (0.70) PTGS2FUT7CYP3A4GPR84ESR1
SCHEMBL4382731 0.84 PTGS2 (0.77) PTGS2CYP3A4
SCHEMBL9420945 0.84 PTGS2 (0.67) PTGS2FUT7CYP3A4GPR84ESR1
SCHEMBL2871788 0.83 PTGS2 (0.68) PTGS2CA1CA2CA9CYP3A4
SCHEMBL30285101 0.82 PTGS2 (0.50) PTGS2FUT7CA1CA2CA9
Ethylene SCHEMBL28058312 0.81 PTGS2 (0.64) PTGS2FUT7CYP3A4GPR84ESR1
SCHEMBL18586439 0.81 PTGS2 (0.73) PTGS2FUT7CA1CA2CA9

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 19 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
CN-1008114-B WATER-IN-OIL EMULSION LUBRIZOL CORP (US) 1990-05-23 CN 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
CN-86108192-A The emulsion of Water in oil 1987-09-09 CN 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