SCHEMBL8660838

SCHEMBL8660838

CCCCCCCCCCCC(N)=O.CCC[N+](C)(C)C.COS(=O)(=O)[O-]

nearest known ligand 0.44

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 3/20 0.44
▸ SOAT1 P35610 2/20 0.44
▸ MEN1 O00255 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
▸ KMT2A Q03164 1/20 0.44
▸ ENPP2 Q13822 4/20 0.43
▸ KDM4E B2RXH2 2/20 0.41
▸ CES2 O00748 4/20 0.40
▸ CES1 P23141 4/20 0.40
▸ RECQL P46063 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ DNM1 Q05193 2/20 0.37

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
SCHEMBL6699378 1.00 FAAH (0.44) FAAHSOAT1MEN1TP53CYP1A2
Octadecanoic Acid Amide SCHEMBL8121892 1.00 FAAH (0.44) FAAHSOAT1MEN1TP53CYP1A2
Palmitamide SCHEMBL14718649 0.90 ENPP2 (0.43) FAAHSOAT1MEN1TP53CYP1A2
Octadecanoic Acid Amide SCHEMBL14718933 0.90 ENPP2 (0.43) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL28118922 0.89 SOAT1 (0.45) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL14734919 0.87 BBOX1 (0.41) MEN1CYP2C19KMT2AENPP2KDM4E
Octadecanoic Acid Amide SCHEMBL1407699 0.86 FAAH (0.45) FAAHSOAT1MEN1TP53CYP1A2
Sulfuric Acid SCHEMBL28483829 0.85 SOAT1 (0.50) FAAHSOAT1MEN1TP53CYP1A2
SCHEMBL27595241 0.85 SOAT1 (0.57) FAAHSOAT1MEN1TP53CYP1A2
Octadecanoic Acid Amide SCHEMBL27994152 0.85 SOAT1 (0.57) FAAHSOAT1MEN1TP53CYP1A2

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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106398214-A Preparation method of polyphenylene sulfide resin for melt-blowing 江苏六鑫洁净新材料有限公司 2017-02-15 — — CN claimed
CN-101736418-B Method for manufacturing polyphenylene sulfide meltblown fiber products XUN CHEN 2011-06-08 — — CN claimed
CN-101736418-A Method for manufacturing polyphenylene sulfide meltblown fiber products XUN CHEN 2010-06-16 — — CN claimed
CN-106457741-A Actinic radiation cured polyurethane coatings for decorative surface coverings 塔吉特GDL公司 2017-02-22 — — CN disclosed
CN-106459619-A Actinic radiation cured polyurethane coating for decorative surface coverings 塔吉特GDL公司 2017-02-22 — — CN disclosed
CN-106398214-A Preparation method of polyphenylene sulfide resin for melt-blowing 江苏六鑫洁净新材料有限公司 2017-02-15 — — CN disclosed
CN-105874005-A Phthalate-free polyvinyl chloride plastisol compositions 塔吉特GDL公司 2016-08-17 — — CN disclosed
CN-105419583-A Powder coating additive, preparation method and application thereof HUBEI NICE & NEW CHEMICAL MAT CO LTD 2016-03-23 — — CN disclosed
CN-104962011-A Preparation method and application of compound PVC (polyvinyl chloride) antistatic agent SHAOXING JAVA MACROMOLECULAR MATERIAL CO LTD 2015-10-07 — — CN disclosed
CN-102604532-B High-reflectivity paint as well as preparation method and application thereof UNIV NANJING INF SCI & TECH 2013-09-18 — — CN disclosed
CN-102214803-B Packaging method of photoelectronic device UNIV ELECTRONIC SCIENCE & TECH 2013-07-17 — — CN disclosed
CN-102604532-A High-reflectivity paint as well as preparation method and application thereof UNIV NANJING INF SCI & TECH 2012-07-25 — — CN disclosed
CN-101736418-B Method for manufacturing polyphenylene sulfide meltblown fiber products XUN CHEN 2011-06-08 — — CN disclosed
CN-101736418-A Method for manufacturing polyphenylene sulfide meltblown fiber products XUN CHEN 2010-06-16 — — CN disclosed
EP-0876453-A1 LIQUID LAUNDRY DETERGENTS CONTAINING SELECTED ALKYL AMIDOALKOYL QUATERNARY AMMONIUM COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1998-11-11 — — EP disclosed
WO-1997012020-A1 LIQUID LAUNDRY DETERGENTS CONTAINING SELECTED ALKYL AMIDOALKOYL QUATERNARY AMMONIUM COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1997-04-03 — — WO disclosed
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