SCHEMBL2032532

SCHEMBL2032532

O=C(Cl)c1ccc(OCCCBr)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.52
GAA P10253 2/20 0.50
PKM P14618 1/20 0.46
MAPT P10636 1/20 0.46
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
PLA2G4B P0C869 2/20 0.44
ALDH1A1 P00352 1/20 0.44
PARP10 Q53GL7 1/20 0.43
PRSS1 P07477 1/20 0.43
TMPRSS2 O15393 1/20 0.43
PPARA Q07869 1/20 0.42
LMNA P02545 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
SCHEMBL9668422 0.95 GAA (0.58) L3MBTL1GAATP53TSHRPLA2G4B
SCHEMBL9680607 0.95 GAA (0.58) L3MBTL1GAATP53TSHRPLA2G4B
SCHEMBL18241699 0.91 L3MBTL1 (0.48) L3MBTL1GAAPKMMAPTTP53
SCHEMBL10390474 0.89 GAA (0.51) L3MBTL1GAATP53TSHRPLA2G4B
SCHEMBL9615211 0.86 GAA (0.66) L3MBTL1GAATP53TSHRPLA2G4B
SCHEMBL10954272 0.86 MAPT (0.59) L3MBTL1GAAPKMMAPTTP53
SCHEMBL19024978 0.85 GAA (0.58) L3MBTL1GAAPKMMAPTTP53
SCHEMBL2039841 0.85 L3MBTL1 (0.55) L3MBTL1GAAPKMMAPTTP53
SCHEMBL12321296 0.85 L3MBTL1 (0.55) L3MBTL1GAAPKMMAPTTP53
SCHEMBL162987 0.83 TP53 (0.64) L3MBTL1GAATP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102070579-B The preparation method of 2-normal-butyl-3-(4-replaces propoxy-benzoyl)-5-substituted-amino cumarone SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2016-03-09 CN claimed
CN-102070579-A Method for preparing 2-n-butyl-3-(4-substituted-propoxybenzoyl)-5-substituted aminobenzofuran SHANGHAI INST PHARM INDUSTRY 2011-05-25 CN claimed
CN-102070579-B The preparation method of 2-normal-butyl-3-(4-replaces propoxy-benzoyl)-5-substituted-amino cumarone SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2016-03-09 CN disclosed
CN-102070577-B 2-normal-butyl-3-(4-replaces propoxy-benzoyl)-5-substituted-amino cumarone and application thereof SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2016-03-09 CN disclosed
CN-102757444-B There is the benzofuran compounds of nitric oxide donors character NANJING XINNUOTHAI PHARMACEUTICAL CO., LTD. (CN) 2016-02-10 CN disclosed
CN-102070581-B The preparation of 2-normal-butyl-3-(4-(the amino propoxy-of 3-di-n-butyl) benzoyl)-5-aminobenzofur SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) 2015-11-25 CN disclosed
CN-102757444-A Benzofuran compound with nitrous oxide donor property JIANGSU SIMCERE PHARM RES CO 2012-10-31 CN disclosed
EP-2509971-A1 NEW PROCESS FOR THE PREPARATION OF DRONEDARONE SANOFI (FR) 2012-10-17 EP disclosed
CN-102741238-A New process for the preparation of dronedarone SANOFI AVENTIS 2012-10-17 CN disclosed
WO-2011070380-A1 NEW PROCESS FOR THE PREPARATION OF DRONEDARONE SANOFI-AVENTIS (FR) 2011-06-16 WO disclosed
CN-102070579-A Method for preparing 2-n-butyl-3-(4-substituted-propoxybenzoyl)-5-substituted aminobenzofuran SHANGHAI INST PHARM INDUSTRY 2011-05-25 CN disclosed
CN-102070581-A Preparation of 2-n-butyl-3-(4-(3-di-n-butylaminopropyl) benzoyl)-5-amino benzofuran SHANGHAI INST PHARM INDUSTRY 2011-05-25 CN disclosed
CN-102070577-A 2-n-butyl-3-(4-subsitituted propylbenzoyl)-5-substituted amino benzofuran and application thereof SHANGHAI INST PHARM INDUSTRY 2011-05-25 CN disclosed
EP-1315710-B1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI AVENTIS (FR) 2007-04-25 EP disclosed
US-7148240-B2 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI-AVENTIS (FR) 2006-12-12 US disclosed
CN-1471520-A Aminoalkyl benzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same ʥŵ��-�ϳ�ʵ���ҹ�˾ 2004-01-28 CN disclosed
US-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same SANOFI (FR) 2004-01-15 US disclosed
EP-1315710-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2003-06-04 EP disclosed
WO-2002016340-A1 AMINOALKOXYBENZOYL-BENZOFURAN OR BENZOTHIOPHENE DERIVATIVES, METHOD FOR PREPARING SAME AND COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-02-28 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040010011-A1 Aminoalkoxybenzoyl-benzofuran or benzothiophene derivatives, method for preparing same and compositions containing same ABAT, TNNT2, BCAT1 L3MBTL1 4238/4885GAA 1255/4885PKM 435/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.