SCHEMBL4315142

SCHEMBL4315142

CCCCCCCCCCCCCCCCCCOCCCN(CCCO)CCCN(CCCO)CCCO

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
THRB P10828 2/20 0.59
HTT P42858 2/20 0.59
MAPT P10636 1/20 0.59
TSHR P16473 2/20 0.48
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
USP2 O75604 1/20 0.43
CES2 O00748 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SPHK1 Q9NYA1 1/20 0.39
CES1 P23141 1/20 0.38
THRA P10827 1/20 0.38

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
SCHEMBL9807780 0.98 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL7298429 0.92 MEN1 (0.59) MEN1KMT2ATHRBHTTMAPT
SCHEMBL7775575 0.90 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL12970034 0.90 MEN1 (0.55) MEN1KMT2ATHRBHTTMAPT
SCHEMBL6129417 0.90 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL572406 0.90 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL6255301 0.90 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL1972096 0.90 MEN1 (0.61) MEN1KMT2ATHRBHTTMAPT
SCHEMBL9549560 0.88 THRB (0.54) MEN1KMT2ATHRBHTTMAPT
SCHEMBL9549581 0.88 THRB (0.54) MEN1KMT2ATHRBHTTMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0000406-A1 Concentrated liquid fabric softener containing mixed active system Procter & Gamble European Technical Center (BE) 1979-01-24 EP claimed
EP-1922397-B1 FABRIC CONDITIONING COMPOSITION UNILEVER PLC (GB) 2013-12-25 EP disclosed
US-20090036346-A1 Fabric Conditioning Composition Henkel IP & Holding GmbH (DE) 2009-02-05 US disclosed
EP-0018039-B2 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1988-08-24 EP disclosed
EP-0043622-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-11-21 EP disclosed
EP-0018039-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-03-07 EP disclosed
US-4422949-A Textile treatment compositions and preparation thereof THE PROCTER & GAMBLE COMPANY (US) 1983-12-27 US disclosed
US-4386000-A IMPROVED VISCOSITY AND STABILITY THE PROCTER & GAMBLE COMPANY (US) 1983-05-31 US disclosed
EP-0060003-A2 Textile treatment compositions and preparation thereof THE PROCTER & GAMBLE COMPANY (US) 1982-09-15 EP disclosed
EP-0043622-A1 Fabric softening composition THE PROCTER & GAMBLE COMPANY (US) 1982-01-13 EP disclosed
EP-0018039-A1 Fabric softening composition THE PROCTER & GAMBLE COMPANY (US) 1980-10-29 EP disclosed
US-4155855-A INCLUDING FABRIC SUBSTANTIVE AGENT; STORAGE STABILITY THE PROCTER & GAMBLE COMPANY (US) 1979-05-22 US disclosed
US-4149978-A CATIONIC FABRIC SOFTENER AND A HYDROCARBON THE PROCTER & GAMBLE COMPANY (US) 1979-04-17 US disclosed
EP-0000406-A1 Concentrated liquid fabric softener containing mixed active system Procter & Gamble European Technical Center (BE) 1979-01-24 EP disclosed