SCHEMBL7051676

SCHEMBL7051676

CCCCCCCCCCCCCCC(N)(CCN)CCCO

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
TSHR P16473 2/20 0.52
HSD17B10 Q99714 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.48
SMPD1 P17405 2/20 0.46
FDPS P14324 2/20 0.46
DNM1 Q05193 8/20 0.41
EPHX1 P07099 1/20 0.41

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
SCHEMBL11146501 1.00 LMNA (0.52) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL6056307 0.92 LMNA (0.62) LMNAALDH1A1MEN1KMT2ATSHR
Fluoride SCHEMBL9761044 0.90 SMPD1 (0.44) LMNAALDH1A1MEN1KMT2ATSHR
SCHEMBL27570389 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL11775656 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL10795207 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL11771930 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL9411168 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL5792250 0.89 DNM1 (0.50) ALDH1A1MEN1KMT2ATSHRSMPD1
SCHEMBL818422 0.85 ALDH1A1 (0.37) LMNAALDH1A1MEN1KMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0990018-B1 ALKALINE ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC (US) 2003-04-23 EP claimed
EP-0847437-B1 ALKYL ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC (US) 2001-07-11 EP claimed
EP-0990018-A1 ALKALINE ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC. (US) 2000-04-05 EP claimed
US-5932526-A CONCENTRATE MIXTURE TO BE DILUTED WITH WATER FOR USE WITHOUT FORMING INSOLUBLE PRECIPITATES AND COMPRISING ALKYLOXYALKYL MONO- OR DIAMINE AND SOLUBILIZING SURFACTANT; FOOD PROCESSING CONVEYORS, ANTIFOULING AGENTS ECOLAB, INC. (US) 1999-08-03 US claimed
US-5863874-A FOR MECHANIZED CONVEYOR SYSTEMS THAT TRANSPORT BEVERAGES, FOODS; NON-PRECIPITATING IN HARD WATER, ANTIMICROBIAL AGENTS REDUCE SLIME FROM SPILLAGE ON CONVEYOR; COMPATIBLE WITH POLYETHYLENE TEREPHTHALATE CONTAINERS ECOLAB INC. (US) 1999-01-26 US claimed
WO-1998059023-A1 ALKALINE ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC. (US) 1998-12-30 WO claimed
EP-0847437-A1 ALKYL ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC. (US) 1998-06-17 EP claimed
WO-1997045508-A1 ALKYL ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC. (US) 1997-12-04 WO claimed
EP-0847437-B1 ALKYL ETHER AMINE CONVEYOR LUBRICANT ECOLAB INC (US) 2001-07-11 EP disclosed