SCHEMBL1769786

SCHEMBL1769786

CCCCOC(CCC)OC(C)O

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 3/20 0.32
SPHK1 Q9NYA1 1/20 0.31
TSHR P16473 1/20 0.31
TP53 P04637 1/20 0.31
DNM1 Q05193 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HSD17B10 Q99714 1/20 0.30
ADRB2 P07550 1/20 0.30
ADRB1 P08588 1/20 0.30
ADRB3 P13945 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
SCHEMBL1769737 0.86 TSHR (0.32) SPHK1TSHRDNM1ALDH1A1HSD17B10
SCHEMBL17746924 0.85 ADRB2 (0.36) TSHRDNM1ALDH1A1ADRB2ADRB1
SCHEMBL8866449 0.84 TSHR (0.31) TSHRDNM1ALDH1A1ADRB2ADRB1
SCHEMBL6381311 0.83 DNM1 (0.32) DNM1ADRB2ADRB1ADRB3
SCHEMBL8866559 0.81 LMNA (0.36) TSHR
SCHEMBL8866541 0.81
SCHEMBL351162 0.80 ADRB2 (0.39) SMPD1TSHRDNM1ALDH1A1ADRB2
SCHEMBL5933448 0.80 DNM1 (0.31) DNM1ADRB2ADRB1ADRB3
SCHEMBL6375076 0.80 DNM1 (0.31) DNM1ADRB2ADRB1ADRB3
SCHEMBL4396855 0.80 CA1 (0.33) TP53DNM1ALDH1A1ADRB2ADRB1

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-8173585-B2 Acidic hard surface cleaning compositions RECKITT BENCKISER (UK) LIMITED (GB) 2012-05-08 US disclosed
US-20110112006-A1 IMPROVEMENTS IN ACIDIC HARD SURFACE CLEANING COMPOSITIONS RECKITT BENCKISER (UK) LIMITED (GB) 2011-05-12 US disclosed
EP-2089500-A1 IMPROVEMENTS IN ACIDIC HARD SURFACE CLEANING COMPOSITIONS Reckitt Benckiser Healthcare (UK) Limited (GB) 2009-08-19 EP disclosed
US-20080242583-A1 Composition and Method RECKITT BENCKISER (UK) LIMITED (GB) 2008-10-02 US disclosed
US-20080171685-A1 Cleaning Composition and Method RECKITT BENCKISER (UK) LIMITED (GB) 2008-07-17 US disclosed
WO-2008068488-A1 IMPROVEMENTS IN ACIDIC HARD SURFACE CLEANING COMPOSITIONS RECKITT BENCKISER (UK) LIMITED (GB) 2008-06-12 WO disclosed
EP-1734106-A1 Cleaning composition and method Reckitt Benckiser (UK) LIMITED (GB) 2006-12-20 EP disclosed
US-5631308-A SELF-POLISHING METALLIZED COPOLYMER KOREA CHEMICAL CO., LTD. (KR) 1997-05-20 US disclosed