SCHEMBL3201279

SCHEMBL3201279

COC(=O)[C@@H]1O[C@H]1c1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.52
TSHR P16473 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.45
EDNRA P25101 2/20 0.45
EDNRB P24530 1/20 0.45
MAPT P10636 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
TP53 P04637 1/20 0.42
HPGD P15428 1/20 0.42
MAOA P21397 1/20 0.42
PTGS2 P35354 1/20 0.42
GABRA1 P14867 2/20 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
SCHEMBL7141149 1.00 BACE1 (0.52) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL3201276 1.00 BACE1 (0.52) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL8573735 1.00 BACE1 (0.52) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL8856846 1.00 BACE1 (0.52) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL8503544 1.00 BACE1 (0.52) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL15446338 0.88 BACE1 (0.46) BACE1TSHRMAPTALDH1A1LMNA
SCHEMBL15446214 0.87 TSHR (0.53) BACE1TSHRSMN1; SMN2EDNRAEDNRB
SCHEMBL7906596 0.86 TSHR (0.54) BACE1TSHRMAPTALDH1A1CA1
SCHEMBL7902731 0.86 TSHR (0.54) BACE1TSHRMAPTALDH1A1CA1
SCHEMBL7906590 0.86 TSHR (0.54) BACE1TSHRMAPTALDH1A1CA1

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 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10975260-B2 Monomers, polymers and coating formulations that comprise at least one N-halamine precursor, a cationic center and a coating incorporation group UNIVERSITY OF MANITOBA (CA) 2021-04-13 US claimed
WO-2014030106-A2 PROCESS FOR PREPARATION OF OPTICALLY ACTIVE (2R,3S)-3-(4- METHOXYPHENYL)GLYCIDIC ACID METHYL ESTER AND CIS LACTAM AND USES THEREOF UNIMARK REMEDIES LTD. (IN) 2014-02-27 WO claimed
EP-1115881-B1 PROCESS FOR THE ENZYMATIC KINETIC RESOLUTION OF 3-PHENYLGLYCIDATES BY TRANSESTERIFICATION WITH AMINOALCOHOLS ZAMBON SPA (IT) 2005-03-30 EP claimed
US-6521445-B1 Stereoselective ester hydrolysis of racemic trans-3-(4-methoxyphenyl) glycidic acid ester using a hydrolase enzyme; resolution; diltiazem production SEPRACOR, INC. 2003-02-18 US claimed
US-6187936-B1 TRANSESTERIFICATION OF MIXTURE OF TRANS ENANTIOMERS CATALYSED BY ENZYMES IN ORGANIC SOLVENT WITH AMINOALCOHOLS TO GIVE MIXTURE OF TRANS ESTERS, NON TRANSESTERIFIED AND TRANSESTERIFIED, HAVING OPPOSITE CONFIGURATION, SEPARATING ZAMBON GROUP S.P.A. (IT) 2001-02-13 US claimed
EP-0498706-B2 Process for the preparation of (-)-(2R,3S)-2,3-epoxy-3-(4-methoxyphenyl)methylpropionate SYNTHELABO (FR) 2000-05-31 EP claimed
EP-0657544-B1 Process for preparing optically active glycidate esters SEPRACOR INC (US) 1997-12-29 EP claimed
JP-2693248-B2 1997-12-24 JP claimed
EP-0453330-B2 Process for the preparation of (-) (2R,3S)-2,3-epoxy-3-(4-methoxyphenyl) propionic acid methylester and its enantiomer SYNTHELABO (FR) 1997-12-03 EP claimed
US-5571704-A Process for the preparation of intermediates useful for the synthesis of benzothiazepines ZAMBON GROUP S.P.A. (IT) 1996-11-05 US claimed
EP-0657544-A1 Process for preparing optically active glycidate esters SEPRACOR, INC. (US) 1995-06-14 EP claimed
EP-0362556-B1 Method for preparing optically active 3-phenylglycidic acid esters TANABE SEIYAKU CO (JP) 1994-11-02 EP claimed
EP-0378455-B1 Process for the preparation of (+)-(2S,3S)-3-hydroxy-2-(4-methoxy-phenyl)-2,3-dihydro-5H-1,5-benzothiazepin-4-one derivatives SYNTHELABO (FR) 1994-04-27 EP claimed
EP-0338893-B1 Process for the preparation of (+)-(2S,3S)-3-(2-aminophenyl) thio-2-hydroxy-3-(4-methoxyphenyl) propionic acid methylester SYNTHELABO (FR) 1994-01-26 EP claimed
US-5274300-A Patent withdrawn after O.G. published SEPRACOR, INC. (US) 1993-12-28 US claimed
EP-0440723-A4 PROCESS FOR PREPARING OPTICALLY ACTIVE GLYCIDATE ESTERS 1992-05-20 EP claimed
EP-0440723-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE GLYCIDATE ESTERS. SEPRACOR INC (US) 1991-08-14 EP claimed
WO-1990004643-A1 PROCESS FOR PREPARING OPTICALLY ACTIVE GLYCIDATE ESTERS SEPRACOR, INC. (US) 1990-05-03 WO claimed
JP-2006468-A None JP disclosed
JP-H00576389-A 0001-01-01 JP disclosed