SCHEMBL7468752

SCHEMBL7468752

CCOC(=O)C(CC)N=Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MIF P14174 4/20 0.58
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CTDSP1 Q9GZU7 1/20 0.44
PIN1 Q13526 1/20 0.44
NPC1 O15118 5/20 0.44
RAB9A P51151 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 3/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
TSHR P16473 1/20 0.41
MMP8 P22894 1/20 0.41
CYP1A2 P05177 1/20 0.40

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
SCHEMBL7468742 1.00 MIF (0.58) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL8306398 0.88 MIF (0.50) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL8470843 0.88 MIF (0.50) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL23797235 0.88 MIF (0.76) MIFMEN1KMT2ANPC1RAB9A
SCHEMBL23797233 0.88 MIF (0.76) MIFMEN1KMT2ANPC1RAB9A
SCHEMBL13201425 0.88 MIF (0.76) MIFMEN1KMT2ANPC1RAB9A
SCHEMBL13925571 0.87 MIF (0.66) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL13925577 0.87 MIF (0.66) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL2589303 0.85 MIF (0.46) MIFMEN1KMT2ACTDSP1PIN1
SCHEMBL2589301 0.85 MIF (0.46) MIFMEN1KMT2ACTDSP1PIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114761080-A Benzothia (di) azepin compounds and their use as bile acid modulators 阿尔比里奥公司 2022-07-15 CN disclosed
CN-114761018-A Benzothiadiazepine compounds and their use as bile acid modulators 阿尔比里奥公司 2022-07-15 CN disclosed
CN-113677398-A Benzothiadiazepine compounds and their use as bile acid modulators 阿尔比里奥公司 2021-11-19 CN disclosed
EP-0775126-B1 HYPOLIPIDEMIC 1,4-BENZOTHIAZEPINE-1,1-DIOXIDES WELLCOME FOUND (GB) 2002-10-30 EP disclosed
EP-0683774-B1 HYPOLIPIDAEMIC COMPOUNDS WELLCOME FOUND (GB) 2002-10-09 EP disclosed
EP-1203769-A1 Hypolipidemic 1,4-benzothiazepine derivative THE WELLCOME FOUNDATION LIMITED (GB) 2002-05-08 EP disclosed
US-5910494-A NOVEL COMPOUNDS THAT REDUCE THE ABSORPTION OF BILE ACIDS FROM THE INTESTINE; FOR PROPHYLAXIS AND TREATMENT OF HYPERLIPIDEMIC CONDITIONS, SUCH AS ATHEROSCLEROSIS GLAXO WELLCOME INC. (US) 1999-06-08 US disclosed
WO-1998038182-A9 HYPOLIPIDEMIC BICYCLIC DERIVATIVES GLAXO GROUP LTD (GB) 1999-04-15 WO disclosed
EP-0626952-B1 HYPOLIPIDAEMIC BENZOTHIAZEPINE COMPOUNDS WELLCOME FOUND (GB) 1999-04-14 EP disclosed
US-5859240-A REDUCTION OF IMINE GROUP; OXIDATION; SALT FORMATION GLAXO WELLCOME INC. (US) 1999-01-12 US disclosed
US-5723458-A 1,4-BENZOTHIAZEPINES GLAXO WELLCOME INC. (US) 1998-03-03 US disclosed
EP-0683773-B1 HYPOLIPIDAEMIC CONDENSED 1,4-THIAZEPINES WELLCOME FOUND (GB) 1997-09-17 EP disclosed
US-5663165-A ANTICHOLESTEROL, CARDIOVASCULAR GLAXO WELLCOME INC. (US) 1997-09-02 US disclosed
EP-0775126-A1 HYPOLIPIDEMIC 1,4-BENZOTHIAZEPINE-1,1-DIOXIDES THE WELLCOME FOUNDATION LIMITED (GB) 1997-05-28 EP disclosed
WO-1996005188-A1 HYPOLIPIDEMIC 1,4-BENZOTHIAZEPINE-1,1-DIOXIDES THE WELLCOME FOUNDATION LIMITED (GB) 1996-02-22 WO disclosed
EP-0683774-A1 HYPOLIPIDAEMIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1995-11-29 EP disclosed
EP-0626952-A1 HYPOLIPIDAEMIC BENZOTHIAZEPINE COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1994-12-07 EP disclosed
WO-1994018184-A1 HYPOLIPIDAEMIC COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1994-08-18 WO disclosed
WO-1994018183-A1 HYPOLIPIDAEMIC CONDENSED 1,4-THIAZEPINES THE WELLCOME FOUNDATION LIMITED (GB) 1994-08-18 WO disclosed
WO-1993016055-A1 HYPOLIPIDAEMIC BENZOTHIAZEPINE COMPOUNDS THE WELLCOME FOUNDATION LIMITED (GB) 1993-08-19 WO disclosed