SCHEMBL165369

SCHEMBL165369

CCCCCCCCC=CCCCCCCCCC(N)CCN

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 5/20 0.49
S1PR1 P21453 5/20 0.49
S1PR3 Q99500 5/20 0.49
S1PR4 O95977 4/20 0.49
FAAH O00519 3/20 0.45
TRPV1 Q8NER1 1/20 0.45
SLC6A5 Q9Y345 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
PLA2G1B P04054 1/20 0.44
PLA2G2A P14555 1/20 0.44
TP53 P04637 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
SOAT1 P35610 1/20 0.44
SPHK1 Q9NYA1 3/20 0.42
GMNN O75496 2/20 0.42
LMNA P02545 2/20 0.42
GLA P06280 2/20 0.42

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
SCHEMBL4176129 1.00 S1PR2 (0.49) S1PR2S1PR1S1PR3S1PR4FAAH
SCHEMBL7929385 1.00 S1PR2 (0.49) S1PR2S1PR1S1PR3S1PR4FAAH
SCHEMBL165367 1.00 S1PR2 (0.49) S1PR2S1PR1S1PR3S1PR4FAAH
Propane SCHEMBL9292282 0.98 S1PR2 (0.47) S1PR2S1PR1S1PR3S1PR4FAAH
SCHEMBL22685806 0.95 KDM4E (0.49) S1PR2S1PR1S1PR3S1PR4TRPV1
Dectaflur SCHEMBL28435673 0.92 SLC6A5 (0.51) S1PR2S1PR1S1PR3S1PR4SLC6A5
SCHEMBL28357369 0.92 SLC6A5 (0.51) S1PR2S1PR1S1PR3S1PR4SLC6A5
SCHEMBL443551 0.92 SLC6A5 (0.51) S1PR2S1PR1S1PR3S1PR4SLC6A5
SCHEMBL4788832 0.92 S1PR2 (0.49) S1PR2S1PR1S1PR3S1PR4FAAH
SCHEMBL448391 0.92 S1PR2 (0.49) S1PR2S1PR1S1PR3S1PR4FAAH

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 55 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3256420-A1 MODIFIED AMINES USEFUL AS SCALE INHIBITORS IN WET PROCESS PHOSPHORIC ACID PRODUCTION Cytec Industries Inc. (US) 2017-12-20 EP claimed
WO-2016130817-A1 MODIFIED AMINES USEFUL AS SCALE INHIBITORS IN WET PROCESS PHOSPHORIC ACID PRODUCTION CYTEC INDUSTRIES INC. (US) 2016-08-18 WO claimed
EP-2611742-A1 COMPOSITION, USE THEREOF AND PROCESS FOR REDUCING BULKING SLUDGE AND/OR FOAMING AND PREPARATION OF THE COMPOSITION Akzo Nobel Chemicals International B.V. (NL) 2013-07-10 EP claimed
EP-2291333-B1 PROCESS FOR REDUCING BULKING SLUDGE IN ACTIVATED SLUDGE WASTEWATER TREATMENT AKZO NOBEL NV (NL) 2013-02-27 EP claimed
WO-2012028592-A1 COMPOSITION, USE THEREOF AND PROCESS FOR REDUCING BULKING SLUDGE AND/OR FOAMING AND PREPARATION OF THE COMPOSITION AKZO NOBEL CHEMICALS INTERNATIONAL B.V. (NL) 2012-03-08 WO claimed
US-20110139714-A1 PROCESS FOR REDUCING BULKING SLUDGE IN ACTIVATED SLUDGE WASTEWATER TREATMENT AKZO NOBEL N.V. (NL) 2011-06-16 US claimed
EP-2291333-A1 PROCESS FOR REDUCING BULKING SLUDGE IN ACTIVATED SLUDGE WASTEWATER TREATMENT Akzo Nobel N.V. (NL) 2011-03-09 EP claimed
WO-2009156252-A1 PROCESS FOR REDUCING BULKING SLUDGE IN ACTIVATED SLUDGE WASTEWATER TREATMENT AKZO NOBEL N.V. (NL) 2009-12-30 WO claimed
JP-2009501810-A 2009-01-22 JP claimed
EP-1907517-A2 AMINE TUNGSTATES AND LUBRICANT COMPOSITIONS King Industries, Inc. (US) 2008-04-09 EP claimed
WO-2007009022-A2 AMINE TUNGSTATES AND LUBRICANT COMPOSITIONS KING INDUSTRIES, INC. (US) 2007-01-18 WO claimed
US-5462681-A Quaternary ammonium salt and amphoteric surfactant, sanatize food processing environments such as brewing and bottling ECOLAB, INC. (US) 1995-10-31 US claimed
EP-4232494-A1 POLYMERIZING COMPOSITION, METHOD OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME The University of Massachusetts (US) 2023-08-30 EP disclosed
WO-2022087097-A1 POLYMERIZING COMPOSITION, METHOD OF MANUFACTURE THEREOF AND ARTICLES COMPRISING THE SAME THE UNIVERSITY OF MASSACHUSETTS (US) 2022-04-28 WO disclosed
EP-3912955-A1 GRAPHENE-INDUCED ENERGY TRANSFER FOR THE QUANTIFICATION OF THE STRUCTURE AND DYNAMICS OF BIOMOLECULES Universität Osnabrück (DE) 2021-11-24 EP disclosed
CN-113686824-A Method and device for quantifying structure and dynamics of biomolecule through graphene-induced energy transfer 游长江 2021-11-23 CN disclosed
US-4459132-A AMINE-ACRYLIC ACID REACTION PRODUCT TEXACO INC. (US) 1984-07-10 US disclosed
US-4412845-A Ethanol or gasohol fuel composition containing as inhibitor a reaction product of itaconic acid and mono-oleyl-1,3-diaminopropane TEXACO INC. (US) 1983-11-01 US disclosed
US-4291112-A QUATERNARY AMMONIUM COMPOUND, AMINE, PYRIDINIUM COMPOUND, OR IMIDAZOLINE COMPOUND XEROX CORPORATION (US) 1981-09-22 US disclosed
US-3964861-A Alkoxylated aliphatic amines to inhibit ozone fading of dyed polyamides ALLIED CHEMICAL CORPORATION (US) 1976-06-22 US disclosed