Butane

Butane

SCHEMBL10785306

CCCC.O=C(O)CO[PH](=O)O

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAM P19021 2/20 0.36
FFAR3 O14843 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
TSHR P16473 5/20 0.35
CTH P32929 1/20 0.35
CBS P35520 1/20 0.35
THPO P40225 1/20 0.35
THRB P10828 1/20 0.33
AKR1B1 P15121 1/20 0.32
GLA P06280 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GPR84 Q9NQS5 7/20 0.31
PPARG P37231 6/20 0.31
PPARD Q03181 6/20 0.31
PPARA Q07869 6/20 0.31
HDAC11 Q96DB2 5/20 0.31
ALDH1A1 P00352 2/20 0.31

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
SCHEMBL11524602 0.90
SCHEMBL10942864 0.87
Butane SCHEMBL10974230 0.81 CES2 (0.39) ALDH1A1TDP1
Butane SCHEMBL9844530 0.79 ALOX15 (0.32) ALOX15
Butane SCHEMBL10937059 0.77 TSHR (0.39) TSHRALDH1A1MEN1KMT2AHSD17B10
Ethyl Hydrogen Phosphonate SCHEMBL26482 0.76 ALDH1A1 (0.32) ALDH1A1HSD17B10
Butane SCHEMBL5481709 0.76 GAA (0.44) TSHRALDH1A1ALOX15KMT2AHSD17B10
SCHEMBL28661379 0.74 ALDH1A1 (0.37) FFAR3HDAC3HDAC1HDAC2HDAC8
Butane SCHEMBL11871540 0.74 LMNA (0.40) TSHRTHRBALDH1A1TDP1MEN1
SCHEMBL11293242 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115947752-B Phosphate ionic liquid, preparation method thereof and application of phosphate ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2024-03-08 CN claimed
CN-117143146-A Amino acid-phosphate proton ionic liquid, preparation method thereof and application of amino acid-phosphate proton ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2023-12-01 CN claimed
CN-115947752-A Phosphate proton type ionic liquid, preparation method thereof and application of phosphate proton type ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2023-04-11 CN claimed
CN-115947752-B Phosphate ionic liquid, preparation method thereof and application of phosphate ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2024-03-08 CN disclosed
CN-117143146-A Amino acid-phosphate proton ionic liquid, preparation method thereof and application of amino acid-phosphate proton ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2023-12-01 CN disclosed
CN-115947752-A Phosphate proton type ionic liquid, preparation method thereof and application of phosphate proton type ionic liquid as basic lubricating liquid additive 烟台先进材料与绿色制造山东省实验室 2023-04-11 CN disclosed
EP-0102115-B1 POLYESTER-ESTER URETHANE AKZO N.V. (NL) 1987-06-10 EP disclosed
US-4483970-A BLOCK POLYMERS, MOLDING MATERIALS AKZO N.V. (NL) 1984-11-20 US disclosed
EP-0063489-B1 4\"-MODIFIED METHYLENE OLEANDOMYCINS PFIZER INC. (US) 1984-06-27 EP disclosed
EP-0102115-A1 Polyester-ester urethane AKZO N.V. (NL) 1984-03-07 EP disclosed
EP-0063489-A1 4\"-Modified methylene oleandomycins PFIZER INC. (US) 1982-10-27 EP disclosed
US-4336368-A 4 Deoxy-4-methylene oleandomycin and derivatives thereof PFIZER INC. (US) 1982-06-22 US disclosed