SCHEMBL454181

SCHEMBL454181

CCCCCCCCCCCCCCCCOC(=O)[C@H]1NCCC1O

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 4/20 0.48
NAAA Q02083 3/20 0.42
PRCP P42785 1/20 0.41
GBA2 Q9HCG7 1/20 0.41
EPHX1 P07099 1/20 0.40
TSHR P16473 2/20 0.39
PPARG P37231 2/20 0.38
GAA P10253 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL15955679 0.94 SPHK1 (0.44) SPHK1PRCPGBA2TSHRSMN1; SMN2
SCHEMBL9863068 0.85 NAAA (0.42) NAAAPRCPEPHX1TSHRPPARG
SCHEMBL9863070 0.82 SLC1A2 (0.49) NAAAPRCPEPHX1PPARG
SCHEMBL116264 0.80 SPHK1 (0.39) SPHK1TSHR
SCHEMBL6846988 0.80 SPHK1 (0.39) SPHK1TSHR
SCHEMBL8427865 0.80 SPHK1 (0.39) SPHK1TSHR
SCHEMBL19973666 0.80 SPHK1 (0.39) SPHK1TSHR
Octane SCHEMBL10527693 0.79 SPHK1 (0.53) SPHK1PRCP
Hydrochloric Acid SCHEMBL4489520 0.79 SPHK1 (0.38) SPHK1MAPK1
Hydrochloric Acid SCHEMBL953016 0.79 SPHK1 (0.38) SPHK1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616169-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS Natrix Separations Inc. (CA) 2013-07-24 EP claimed
WO-2012037101-A2 CHROMATOGRAPHY MEMBRANES FOR THE PURIFICATION OF CHIRAL COMPOUNDS NATRIX SEPARATIONS INC. (CA) 2012-03-22 WO claimed
US-20120064601-A1 Chromatography Membranes for the Purification of Chiral Compounds NATRIX SEPARATIONS INC. (CA) 2012-03-15 US claimed
US-20230265268-A1 THERMOPLASTIC ELASTOMER COMPOSITION POLYMAX THERMOPLASTIC ELASTOMERS, LLC 2023-08-24 US disclosed
EP-2904046-B1 THERMOPLASTIC ELASTOMER COMPOSITIONS HAVING BIORENEWABLE CONTENT TEKNOR APEX CO (US) 2018-11-21 EP disclosed
US-10125255-B2 Thermoplastic elastomer compositions having biorenewable content TEKNOR APEX COMPANY (US) 2018-11-13 US disclosed
EP-2904045-B1 THERMOPLASTIC ELASTOMER COMPOSITIONS HAVING BIORENEWABLE CONTENT TEKNOR APEX CO (US) 2018-09-19 EP disclosed
US-20160376432-A1 THERMOPLASTIC ELASTOMER COMPOSITIONS HAVING BIORENEWABLE CONTENT CERESTECH, INC. (CA) 2016-12-29 US disclosed
EP-1256336-B1 Two-phase gel composition PENRECO (US) 2016-10-19 EP disclosed
US-9339446-B2 Gel composition CALUMET PENRECO, LLC (US) 2016-05-17 US disclosed
EP-2982364-A1 OIL-IN-WATER EMULSION COMPOSITION FUJIFILM Corporation (JP) 2016-02-10 EP disclosed
EP-1256336-A2 Two-phase gel composition Penreco (US) 2002-11-13 EP disclosed
US-20020055562-A1 Gel compositions WILMINGTON TRUST, NATIONAL ASSOCIATION 2002-05-09 US disclosed
EP-1203141-A1 LINKAGE OF AGENTS TO TISSUE Pericor Science, Inc. (US) 2002-05-08 EP disclosed
EP-1202706-A1 LYSINE OXIDASE LINKAGE OF AGENTS TO TISSUE Pericor Science, Inc. (US) 2002-05-08 EP disclosed
WO-2002007707-A2 LINKAGE OF AGENTS USING MICROPARTICLES PERICOR SCIENCE, INC. (US) 2002-01-31 WO disclosed
EP-1141111-A1 GEL COMPOSITIONS Penreco (US) 2001-10-10 EP disclosed
WO-2001007009-A1 LYSINE OXIDASE LINKAGE OF AGENTS TO TISSUE PERICOR SCIENCE, INC. (US) 2001-02-01 WO disclosed
WO-2001006829-A2 LINKAGE OF AGENTS TO TISSUE PERICOR SCIENCE, INC. (US) 2001-02-01 WO disclosed
WO-2000026285-A1 GEL COMPOSITIONS PENRECO (US) 2000-05-11 WO disclosed