SCHEMBL944831

SCHEMBL944831

CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O.CCCC=CC(N)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
FAAH O00519 3/20 0.40
SOAT1 P35610 2/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
CNR1 P21554 1/20 0.38
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
PTPN1 P18031 1/20 0.36
MAPT P10636 1/20 0.36
GABRR1 P24046 2/20 0.35
GABRR2 P28476 2/20 0.35
BLM P54132 2/20 0.35
GABRR3 A8MPY1 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL943834 1.00 TAS1R3 (0.45) TAS1R3TAS1R1FAAHSOAT1MEN1
SCHEMBL1873475 1.00
SCHEMBL1873474 1.00
SCHEMBL3504009 1.00
Butane SCHEMBL8373879 0.97 TAS1R3 (0.44) TAS1R3TAS1R1FAAHSOAT1MEN1
Dimethylamine SCHEMBL3824284 0.93 TAS1R3 (0.46) TAS1R3TAS1R1FAAHSOAT1MEN1
Trimethylammonium SCHEMBL2776569 0.93 TAS1R3 (0.41) TAS1R3TAS1R1FAAHSOAT1MEN1
Trimethylammonium SCHEMBL2376096 0.91 TAS1R3 (0.40) TAS1R3TAS1R1FAAHSOAT1MEN1
Sulfuric Acid SCHEMBL28329966 0.91 TAS1R3 (0.40) TAS1R3TAS1R1FAAHSOAT1MEN1
Hydrochloric Acid SCHEMBL17289000 0.87 TAS1R3 (0.38) TAS1R3TAS1R1FAAHSOAT1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115315547-B Spun-bonded nonwoven fabric 东丽株式会社 2024-09-24 CN disclosed
CN-115151689-B Laminated nonwoven fabric and sanitary material 东丽株式会社 2024-03-12 CN disclosed
CN-116981804-A Spun-bonded nonwoven fabric, laminated nonwoven fabric, method for producing same, and sanitary material 东丽株式会社 2023-10-31 CN disclosed
CN-115003872-B Laminated nonwoven fabric and sanitary material 东丽株式会社 2023-07-04 CN disclosed
CN-115315547-A Spun-bonded non-woven fabric 东丽株式会社 2022-11-08 CN disclosed
CN-115151689-A Laminated nonwoven fabric and sanitary material 东丽株式会社 2022-10-04 CN disclosed
CN-115003872-A Laminated nonwoven fabric and sanitary material 东丽株式会社 2022-09-02 CN disclosed
US-20110008723-A1 TONER COLORANT, ELECTROPHOTOGRAPHIC TONER, TWO-COMPONENT DEVELOPER, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2011-01-13 US disclosed