SCHEMBL7029045

SCHEMBL7029045

CCCCCCC1CCCCN1CCCCCC

nearest known ligand 0.71

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 3/20 0.71
S1PR3 Q99500 3/20 0.71
S1PR5 Q9H228 3/20 0.71
S1PR4 O95977 1/20 0.61
CHRNB2 P17787 1/20 0.49
CHRNA7 P36544 1/20 0.49
CHRNA4 P43681 1/20 0.49
SPHK2 Q9NRA0 3/20 0.44
SPHK1 Q9NYA1 3/20 0.44
OPRD1 P41143 1/20 0.41
GBA1 P04062 1/20 0.41
GNAI3 P08754 2/20 0.40
GNAO1 P09471 2/20 0.40
GNAI1 P63096 2/20 0.40
ALOX15 P16050 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL27959074 1.00 S1PR1 (0.71) S1PR1S1PR3S1PR5S1PR4CHRNB2
SCHEMBL28663946 1.00 S1PR1 (0.71) S1PR1S1PR3S1PR5S1PR4CHRNB2
SCHEMBL27959059 1.00 S1PR1 (0.71) S1PR1S1PR3S1PR5S1PR4CHRNB2
SCHEMBL27602528 1.00 S1PR1 (0.71) S1PR1S1PR3S1PR5S1PR4CHRNB2
Hydrochloric Acid SCHEMBL10335558 0.98 S1PR1 (0.69) S1PR1S1PR3S1PR5S1PR4CHRNB2
SCHEMBL3802751 0.98 S1PR1 (0.68) S1PR1S1PR3S1PR5S1PR4CHRNB2
Hydrochloric Acid SCHEMBL30331012 0.95 S1PR1 (0.65) S1PR1S1PR3S1PR5S1PR4CHRNB2
Fluoride SCHEMBL30330748 0.95 S1PR1 (0.65) S1PR1S1PR3S1PR5S1PR4CHRNB2
Fluoride SCHEMBL30330997 0.95 S1PR1 (0.65) S1PR1S1PR3S1PR5S1PR4CHRNB2
Fluoride SCHEMBL30330978 0.95 S1PR1 (0.65) S1PR1S1PR3S1PR5S1PR4CHRNB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115991633-B Method for preparing methanol and ethylene glycol and co-producing formic acid by photocatalysis of polyalcohol 中国科学院大连化学物理研究所 2024-06-25 CN claimed
CN-115991633-A Method for preparing methanol and ethylene glycol and co-producing formic acid by photocatalysis of polyalcohol 中国科学院大连化学物理研究所 2023-04-21 CN claimed
CN-104073910-B Application of the ionic liquid in polyethylene terephthalate composite fibre 浙江佳华精化股份有限公司 2017-06-20 CN claimed
CN-104073900-B Application of ionic liquid to polyurethane complex fiber 杭州师范大学 2017-05-10 CN claimed
CN-104073901-B The application in polyurethane composite fibre of the nitrogen containing plasma liquid 杭州师范大学 2017-01-04 CN claimed
CN-104073899-B Ionic liquid application in PLA Composite Fiber 杭州师范大学 2016-09-14 CN claimed
CN-104073900-A Application of ionic liquid to polyurethane complex fiber UNIV HANGZHOU NORMAL 2014-10-01 CN claimed
CN-104073901-A Application of nitrogen-contained ionic liquid to polyurethane complex fiber UNIV HANGZHOU NORMAL 2014-10-01 CN claimed
CN-104073910-A Application of ionic liquid in polyethylene terephthalate composite fiber SHAOXING JAVA MACROMOLECULAR MATERIAL CO LTD 2014-10-01 CN claimed
CN-104073899-A Application of ionic liquid in polylactic acid composite fibers UNIV HANGZHOU NORMAL 2014-10-01 CN claimed
CN-117043136-A Fluorine-based ionic liquid and method for producing same 第一工业制药株式会社 2023-11-10 CN disclosed
CN-104073900-B Application of ionic liquid to polyurethane complex fiber 杭州师范大学 2017-05-10 CN disclosed
CN-104073901-B The application in polyurethane composite fibre of the nitrogen containing plasma liquid 杭州师范大学 2017-01-04 CN disclosed
CN-104073899-B Ionic liquid application in PLA Composite Fiber 杭州师范大学 2016-09-14 CN disclosed
CN-102639480-B Method for producing alizarin derivative compound, novel alizarin derivative compound, surface modification method, photoelectric conversion film, photoelectric conversion element, and electrophotographic photoreceptor FUJIFILM CORP. (JP) 2015-10-07 CN disclosed
CN-104073900-A Application of ionic liquid to polyurethane complex fiber UNIV HANGZHOU NORMAL 2014-10-01 CN disclosed
CN-102639480-A Method for producing alizarin derivative compound, novel alizarin derivative compound, surface modification method, photoelectric conversion film, photoelectric conversion element, and electrophotographic photoreceptor FUJIFILM CORP 2012-08-15 CN disclosed
EP-0789062-B1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL IND LTD (JP) 2003-01-22 EP disclosed
US-5994421-A CROSSLINKING SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1999-11-30 US disclosed
EP-0789062-A1 WATER-ABSORBENT RESIN DISPERSION AND POLYURETHANE COMPOSITION SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1997-08-13 EP disclosed