Butyrophenone

Butyrophenone

SCHEMBL28262155

CCCC(=O)c1ccccc1.CCCCOC(=O)O

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 7/20 0.56
HPGD P15428 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
TDP1 Q9NUW8 4/20 0.51
TSHR P16473 3/20 0.51
LMNA P02545 2/20 0.50
MAPT P10636 1/20 0.50
CES2 O00748 3/20 0.47
CES1 P23141 3/20 0.47
HSD17B3 P37058 1/20 0.47
CYP3A4 P08684 2/20 0.47
MAPK1 P28482 2/20 0.47
ALDH1A1 P00352 2/20 0.47
TP53 P04637 1/20 0.46
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46

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
Butyrophenone SCHEMBL28260781 0.90 LMNA (0.61) L3MBTL1HPGDSMN1; SMN2TDP1LMNA
Propiophenone SCHEMBL28515262 0.89 TSHR (0.53) L3MBTL1SMN1; SMN2TDP1TSHRLMNA
SCHEMBL7720290 0.84 TDP1 (0.64) L3MBTL1HPGDSMN1; SMN2TDP1LMNA
Propiophenone SCHEMBL28519981 0.84 TSHR (0.54) L3MBTL1SMN1; SMN2TDP1TSHRLMNA
Acetophenone SCHEMBL28519002 0.83 LMNA (0.56) L3MBTL1HPGDSMN1; SMN2TDP1TSHR
Propiophenone SCHEMBL28867194 0.83 LMNA (0.55) L3MBTL1SMN1; SMN2TDP1TSHRLMNA
Propiophenone SCHEMBL28519989 0.83 LMNA (0.55) L3MBTL1SMN1; SMN2TDP1TSHRLMNA
Butyrophenone SCHEMBL25423577 0.82 L3MBTL1 (0.77) L3MBTL1HPGDSMN1; SMN2TDP1LMNA
Butyrophenone SCHEMBL82532 0.82 L3MBTL1 (0.77) L3MBTL1HPGDSMN1; SMN2TDP1LMNA
Butyrophenone SCHEMBL9725428 0.82 L3MBTL1 (0.77) L3MBTL1HPGDSMN1; SMN2TDP1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109111537-A Catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-01-01 CN disclosed
CN-109111539-A Catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-01-01 CN disclosed
CN-109111538-A Catalytic component and its catalyst for olefinic polymerization 中国石油化工股份有限公司 2019-01-01 CN disclosed