SCHEMBL6940499

SCHEMBL6940499

O=C(CCCCC(=O)NCCCO)NCCCO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.54
CNR1 P21554 4/20 0.53
DNM1 Q05193 1/20 0.52
FAAH O00519 3/20 0.50
TSHR P16473 2/20 0.50
CASP2 P42575 1/20 0.46
TP53 P04637 1/20 0.46
MAPK1 P28482 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
SELP P16109 1/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
TRPV1 Q8NER1 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
ALOX12 P18054 1/20 0.44
BLM P54132 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL14984043 0.97 NAAA (0.57) NAAACNR1DNM1FAAHTSHR
SCHEMBL9754512 0.95 NAAA (0.55) NAAACNR1DNM1FAAHTSHR
SCHEMBL9717404 0.95 TSHR (0.56) NAAACNR1DNM1FAAHTSHR
SCHEMBL620134 0.95 NAAA (0.54) NAAACNR1DNM1FAAHTSHR
SCHEMBL16392705 0.93 CNR1 (0.49) NAAACNR1DNM1FAAHTSHR
SCHEMBL9717412 0.92 NAAA (0.56) NAAACNR1DNM1FAAHTSHR
SCHEMBL3640964 0.91 CNR1 (0.47) NAAACNR1DNM1FAAHTSHR
SCHEMBL25447807 0.90 NAAA (0.61) NAAACNR1DNM1FAAHTSHR
SCHEMBL15006922 0.90 NAAA (0.61) NAAACNR1DNM1FAAHTSHR
SCHEMBL13402876 0.90 NAAA (0.61) NAAACNR1DNM1FAAHTSHR

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
EP-1261670-B1 THERMOSETTING COATING MASS EMS CHEMIE AG (CH) 2003-09-10 EP claimed
US-20230211599-A1 Lithographic Photopolymer Printing Plate Precursor with Improved Daylight Stability AGFA OFFSET BV (BE) 2023-07-06 US disclosed
US-20230211599-A1 Lithographic Photopolymer Printing Plate Precursor with Improved Daylight Stability AGFA OFFSET BV (BE) 2023-07-06 US disclosed
US-9568822-B2 Lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2017-02-14 US disclosed
US-9482954-B2 Lithographic printing plate precursor AGFA GRAPHICS NV (BE) 2016-11-01 US disclosed
US-20160116841-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR ECO3 BV (BE) 2016-04-28 US disclosed
US-20160070173-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2016-03-10 US disclosed
WO-2014198820-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2014-12-18 WO disclosed
WO-2014198823-A1 A LITHOGRAPHIC PRINTING PLATE PRECURSOR AGFA GRAPHICS NV (BE) 2014-12-18 WO disclosed
US-5086104-A Mixture of thermoplastic resin, elastomer and amide compound, excellent toughtness, heat resistance and durability POLYPLASTICS CO., LTD. (JP) 1992-02-04 US disclosed
US-4687834-A Polyester imides and method for producing same HULS AKTIENGESELLSCHAFT (DE) 1987-08-18 US disclosed