SCHEMBL4307685

SCHEMBL4307685

CCCCCCCCCCCCCC[N+](C)(CCO)Cc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 4/20 0.63
MEN1 O00255 3/20 0.61
KMT2A Q03164 3/20 0.61
MAPK1 P28482 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
TP53 P04637 1/20 0.61
HTT P42858 3/20 0.59
BCHE P06276 1/20 0.48
ACHE P22303 1/20 0.48
PSMD14 O00487 2/20 0.43
MMP2 P08253 2/20 0.43
RAD52 P43351 2/20 0.43
HSP90AA1 P07900 1/20 0.43
MC4R P32245 1/20 0.43
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
ESR1 P03372 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42

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
SCHEMBL8871547 1.00 DNM1 (0.63) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18140459 0.98 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18139335 0.98 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18139320 0.98 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18141465 0.98 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18141522 0.98 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18139973 0.98 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18140342 0.98 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Bromide SCHEMBL18140552 0.98 DNM1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL18139148 0.98 MEN1 (0.64) DNM1MEN1KMT2AMAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104302750-B The improvement related with fabric conditioner 荷兰联合利华有限公司 2018-06-19 CN disclosed
EP-2855648-B1 IMPROVEMENTS RELATING TO FABRIC CONDITIONERS UNILEVER PLC (GB) 2015-12-02 EP disclosed
EP-2855648-A1 IMPROVEMENTS RELATING TO FABRIC CONDITIONERS Unilever PLC (GB) 2015-04-08 EP disclosed
CN-104302750-A Improvements relating to fabric conditioners UNILEVER NV 2015-01-21 CN disclosed
EP-1922397-B1 FABRIC CONDITIONING COMPOSITION UNILEVER PLC (GB) 2013-12-25 EP disclosed
WO-2013174603-A1 IMPROVEMENTS RELATING TO FABRIC CONDITIONERS UNILEVER PLC (GB) 2013-11-28 WO disclosed
US-20090036346-A1 Fabric Conditioning Composition Henkel IP & Holding GmbH (DE) 2009-02-05 US disclosed
EP-1922397-A1 FABRIC CONDITIONING COMPOSITION Unilever Plc (GB) 2008-05-21 EP disclosed
WO-2007028495-A1 FABRIC CONDITIONING COMPOSITION UNILEVER PLC (GB) 2007-03-15 WO disclosed
EP-0056695-B2 TEXTILE TREATMENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1987-09-09 EP disclosed
EP-0056695-B1 TEXTILE TREATMENT COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1985-05-29 EP disclosed
EP-0043622-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-11-21 EP disclosed
US-4476031-A CATIONIC AND NONIONIC SOFTENER AND POLYOXALKYLENE AMINE THE PROCTER & GAMBLE COMPANY (US) 1984-10-09 US disclosed
US-4439330-A FABRIC SOFTENER, QUATERNARY AMMONIUM SALT, ETHOXYLATED AMINE, POLYOXYETHYLENE GLYCOL THE PROCTER & GAMBLE COMPANY (US) 1984-03-27 US disclosed
EP-0018039-B1 FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1984-03-07 EP disclosed
US-4386000-A IMPROVED VISCOSITY AND STABILITY THE PROCTER & GAMBLE COMPANY (US) 1983-05-31 US disclosed
EP-0056695-A2 Textile treatment compositions THE PROCTER & GAMBLE COMPANY (US) 1982-07-28 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