SCHEMBL7169402

SCHEMBL7169402

CCCCCCC[C](N)N

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.62
SPHK1 Q9NYA1 1/20 0.62
CES2 O00748 3/20 0.52
CES1 P23141 3/20 0.52
GPR84 Q9NQS5 7/20 0.50
PPARG P37231 6/20 0.50
PPARD Q03181 6/20 0.50
PPARA Q07869 6/20 0.50
TSHR P16473 5/20 0.50
HDAC11 Q96DB2 5/20 0.50
ALDH1A1 P00352 2/20 0.50
TLR2 O60603 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
MEN1 O00255 2/20 0.50
FABP4 P15090 2/20 0.50
PTPN1 P18031 2/20 0.50
KMT2A Q03164 2/20 0.50
SLC22A6 Q4U2R8 1/20 0.50
SLC22A8 Q8TCC7 1/20 0.50
ESR1 P03372 1/20 0.50

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
SCHEMBL16446913 1.00 SPHK2 (0.62) SPHK2SPHK1CES2CES1GPR84
SCHEMBL11044271 1.00 SPHK2 (0.62) SPHK2SPHK1CES2CES1GPR84
SCHEMBL11532996 1.00 SPHK2 (0.62) SPHK2SPHK1CES2CES1GPR84
SCHEMBL2002942 1.00
Hydrochloric Acid SCHEMBL21875997 0.97 SPHK2 (0.59) SPHK2SPHK1CES2CES1GPR84
SCHEMBL337474 0.97
SCHEMBL892806 0.87
Octadecanoic Acid Amide SCHEMBL27869 0.79 SOAT1 (0.74) CES2CES1GPR84PPARGPPARD
SCHEMBL6046254 0.79 SOAT1 (0.74) CES2CES1GPR84PPARGPPARD
SCHEMBL22319678 0.79 SOAT1 (0.74) CES2CES1GPR84PPARGPPARD

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
US-6573109-B1 Membrane for use in detecting an analyte; membrane comprises an array of closely packed self-assembling amphiphilic molecules and a plurality of first and second receptor molecules AUSTRALIAN MEMBRANE AND BIOTECHNOLOGY RESEARCH INSTITUTE (AU) 2003-06-03 US disclosed
EP-0695425-B1 SURFACE AMPLIFIER AMBRI LTD (AU) 2002-09-25 EP disclosed
EP-0695425-A4 SURFACE AMPLIFIER AU MEMBRANE & BIOTECH RES INST (AU) 1999-08-25 EP disclosed
EP-0695425-A1 SURFACE AMPLIFIER AUSTRALIAN MEMBRANE AND BIOTECHNOLOGY RESEARCH INSTITUTE (AU) 1996-02-07 EP disclosed
WO-1994024562-A1 SURFACE AMPLIFIER AUSTRALIAN MEMBRANE & BIOTECHNOLOGY RESEARCH INSTITUTE (AU) 1994-10-27 WO disclosed
US-4122062-A FILLERS KENRICH PETROCHEMICALS, INC. (US) 1978-10-24 US disclosed
US-4098758-A ORGANIC ACIDS, FOR USE IN POLYMER SYSTEMS KENRICH PETROCHEMICALS, INC. (US) 1978-07-04 US disclosed
US-4096110-A Filled polyesters containing organic titanate esters KENRICH PETROCHEMICALS, INC. (US) 1978-06-20 US disclosed
US-4094853-A Alkoxy titanate salts useful as coupling agents KENRICH PETROCHEMICALS, INC. (US) 1978-06-13 US disclosed
US-4087402-A USED FOR TREATMENT OF INORGANIC FILLERS KENRICH PETROCHEMICALS, INC. (US) 1978-05-02 US disclosed
US-4069192-A ORGANIC KENRICH PETROCHEMICALS, INC. (US) 1978-01-17 US disclosed