SCHEMBL10659592

SCHEMBL10659592

C=CCC(CC(=O)NCCO)N(CCO)CCO

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 4/20 0.33
ALDH1A1 P00352 3/20 0.32
MAPT P10636 3/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
USP2 O75604 1/20 0.32
CNR1 P21554 2/20 0.30
HPGD P15428 2/20 0.30
TRPV1 Q8NER1 1/20 0.30
ALOX12 P18054 1/20 0.30
BLM P54132 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL1286476 0.72
Hypochlorous Acid SCHEMBL28319310 0.69
Sulfuric Acid SCHEMBL6419257 0.68
SCHEMBL11270165 0.66
SCHEMBL5061748 0.66
SCHEMBL27850316 0.64 GRIK1 (0.36)
SCHEMBL13528442 0.63 CNR1 (0.53) TSHRSMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL28064676 0.62
Sulfuric Acid SCHEMBL29551565 0.62
SCHEMBL27978543 0.62 FAAH (0.31) TSHRALDH1A1

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
US-4744911-A AMINES, PHOSPHATE ESTERS AND MAINE OXIDES THE PROCTER & GAMBLE COMPANY (US) 1988-05-17 US disclosed
EP-0135217-B1 ETHOXYLATED AMINE OXIDES HAVING CLAY SOIL REMOVAL/ANTI-REDEPOSITION PROPERTIES USEFUL IN DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1988-02-10 EP disclosed
EP-0091802-B1 FOAM-CONTROLLING DETERGENT ADDITIVE COMPOSITIONS AND USE THEREOF IN DETERGENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1987-09-30 EP disclosed
US-4548744-A Ethoxylated amine oxides having clay soil removal/anti-redeposition properties useful in detergent compositions PROCTER & GAMBLE COMPANY, THE AN OH CORP. 1985-10-22 US disclosed
EP-0135217-A1 Ethoxylated amine oxides having clay soil removal/anti-redeposition properties useful in detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1985-03-27 EP disclosed
US-4470923-A ANIONIC SURFACTANTS, NONIONIC SURFACTANTS THE PROCTER & GAMBLE COMPANY (US) 1984-09-11 US disclosed
US-4391726-A Detergent composition containing low levels of amine oxides THE PROCTER & GAMBLE COMPANY (US) 1983-07-05 US disclosed
EP-0042188-A1 Detergent composition containing low levels of amine oxides THE PROCTER & GAMBLE COMPANY (US) 1981-12-23 EP disclosed