Trimethylammonium

Trimethylammonium

SCHEMBL28010669

CC(O)COc1ccc(C(=O)c2ccccc2)cc1.CN(C)C

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.67
LMNA P02545 4/20 0.62
MAPK1 P28482 3/20 0.54
GAA P10253 1/20 0.54
ALDH1A1 P00352 2/20 0.53
USP2 O75604 1/20 0.53
ELANE P08246 2/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
HTT P42858 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
MAPT P10636 1/20 0.50

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
SCHEMBL4200509 0.95 LMNA (0.68) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL9618955 0.94 ABCB1 (0.66) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL31098144 0.94 ABCB1 (0.66) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL10592803 0.89 LMNA (0.60) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL16526411 0.84 MAPT (0.67) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL6552266 0.82 ABCB1 (0.76) ABCB1LMNAMAPK1ALDH1A1USP2
SCHEMBL18543110 0.82 ABCB1 (0.71) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL9075178 0.82 ABCB1 (0.62) ABCB1LMNAMAPK1GAAALDH1A1
SCHEMBL11884564 0.81 ABCB1 (0.62) ABCB1LMNAMAPK1GAAALDH1A1
Hydrochloric Acid SCHEMBL22228312 0.81 ABCB1 (0.74) ABCB1LMNAMAPK1ALDH1A1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104649914-A Preparation method of chloride (2-hydroxy-3-(4-benzoyl phenoxy)-N,N,N-trimethyl-1-propylanmine) QINGDAO EAA RUBBER IND CO LTD 2015-05-27 CN disclosed
CN-104649914-A Preparation method of chloride (2-hydroxy-3-(4-benzoyl phenoxy)-N,N,N-trimethyl-1-propylanmine) QINGDAO EAA RUBBER IND CO LTD 2015-05-27 CN disclosed