SCHEMBL6553756

SCHEMBL6553756

O=C(ONCc1ccccc1)[C@H](O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.47
MAPK1 P28482 1/20 0.47
MAPT P10636 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
ACP3 P15309 2/20 0.42
BCHE P06276 1/20 0.42
NAAA Q02083 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL28014617 0.81 LMNA (0.48) LMNAMAPK1ALDH1A1KMT2ACES2
SCHEMBL366884 0.80 ALPI (0.56)
SCHEMBL20424193 0.80 SMN1; SMN2 (0.44) MAPTALDH1A1KMT2AMEN1L3MBTL1
SCHEMBL9617184 0.79 MAPT (0.43) LMNAMAPK1MAPTALDH1A1BCHE
SCHEMBL8876742 0.78 LMNA (0.54) LMNAMAPK1ALDH1A1KMT2AMEN1
SCHEMBL2806899 0.78 LMNA (0.46) LMNAMAPK1ALDH1A1KMT2ACES2
SCHEMBL6429495 0.77 THRB (0.48) LMNAALDH1A1KMT2AMEN1CYP2C19
SCHEMBL11176841 0.77 THRB (0.48) LMNAALDH1A1KMT2AMEN1CYP2C19
SCHEMBL536227 0.77 ALDH1A1 (0.55) LMNAMAPK1ALDH1A1KMT2ACES2
SCHEMBL5117818 0.77 ALDH1A1 (0.55) LMNAMAPK1ALDH1A1KMT2ACES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082293-B1 FORMOTEROL POLYMORPHS SEPRACOR INC (US) 2004-02-18 EP disclosed
EP-1093450-B1 DESFORMOTEROL AND PROCESS FOR ITS PREPARATION SEPRACOR INC (US) 2003-04-23 EP disclosed
EP-0938467-B1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR INC (US) 2002-06-12 EP disclosed
US-6268533-B1 REACTING 4-BENZYLOXY-3-FORMAMIDOSTYRENE OXIDE WITH AN OPTICALLY PURE 4-METHOXY-.ALPHA.-METHYL-N-(PHENYLMETHYL)BENZENEETHANAMINE FOLLOWED BY REDUCTION TO PRODUCE FORMOTEROL SEPRACOR INC. 2001-07-31 US disclosed
EP-1093450-A1 DESFORMOTEROL AND PROCESS FOR ITS PREPARATION Sepracor Inc. (US) 2001-04-25 EP disclosed
EP-1082293-A2 FORMOTEROL POLYMORPHS Sepracor Inc. (US) 2001-03-14 EP disclosed
US-6071971-A FOR TREATING PULMONARY DISORDERS SEPRACOR INC. (US) 2000-06-06 US disclosed
WO-2000021487-A2 FORMOTEROL POLYMORPHS SEPRACOR INC. (US) 2000-04-20 WO disclosed
US-6040344-A CRYSTALLINE R,R-FORMOTEROL L-(+)-TARTRATE. SEPRACOR INC. (US) 2000-03-21 US disclosed
WO-1999067198-A1 DESFORMOTEROL AND PROCESS FOR ITS PREPARATION SEPRACOR INC. (US) 1999-12-29 WO disclosed
US-5965622-A BRONCHODILATORS; HIGHLY SELECTIVE BETA 2-ADRENERGIC RECEPTOR AGONIST; RESPIRATORY DISORDERS, E.G. ASTHMA, BRONCHITIS; REDUCTION OF A PROTECTED NITRO DERIVATIVE; STEREOSPECIFIC SEPRACOR INC. (US) 1999-10-12 US disclosed
EP-0938467-A1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR, INC. (US) 1999-09-01 EP disclosed
WO-1998021175-A1 PROCESS FOR THE PREPARATION OF OPTICALLY PURE ISOMERS OF FORMOTEROL SEPRACOR, INC. (US) 1998-05-22 WO disclosed