SCHEMBL1817895

SCHEMBL1817895

[CH2]COC(=O)c1cccnc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.64
LMNA P02545 4/20 0.64
TDP1 Q9NUW8 3/20 0.64
L3MBTL1 Q9Y468 1/20 0.62
MAPK1 P28482 1/20 0.61
ALDH1A1 P00352 5/20 0.61
KDM4E B2RXH2 1/20 0.59
MAPT P10636 1/20 0.57
MEN1 O00255 1/20 0.57
USP2 O75604 1/20 0.57
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2D6 P10635 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
AGTR1 P30556 1/20 0.54
CYP2C19 P33261 1/20 0.54
GAA P10253 2/20 0.53
APP P05067 1/20 0.53
HCAR3 P49019 1/20 0.53

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
SCHEMBL4196772 0.86 L3MBTL1 (0.68) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL25009812 0.85 L3MBTL1 (0.76) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL30556174 0.85 L3MBTL1 (0.76) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL14741028 0.84 LMNA (0.66) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL17978281 0.84 KMT2A (0.66) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL4204510 0.83 L3MBTL1 (0.73) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL837646 0.82 LMNA (0.64) KMT2ALMNATDP1L3MBTL1MAPK1
SCHEMBL21243071 0.82 LMNA (0.82) KMT2ALMNATDP1L3MBTL1MAPK1
Ethyl Nicotinate SCHEMBL8164637 0.82 L3MBTL1 (0.71) KMT2ALMNATDP1L3MBTL1MAPK1
Ethyl Nicotinate SCHEMBL1330922 0.82 L3MBTL1 (0.71) KMT2ALMNATDP1L3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011056126-A1 NOVEL 1,3-OXAZOLIDINE COMPOUNDS AND THEIR USE AS RENIN INHIBITORS NOVADEX PHARMACEUTICALS AB (SE) 2011-05-12 WO claimed
EP-0532446-A1 Use of xanthines in the treatment or prevention of hypeoglycemia NOVO NORDISK A/S (DK) 1993-03-17 EP claimed
WO-1993003727-A1 USE OF CERTAIN XANTHINE DERIVATIVES AND THEIR PHARMACEUTICALLY ACCEPTABLE SALTS FOR THE MANUFACTURE OF A MEDICAMENT USEFUL FOR COUNTERACTING HYPOCLYCAEMIA NOVO NORDISK A/S (DK) 1993-03-04 WO claimed
WO-2024080351-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2024-04-18 WO disclosed
WO-2024058164-A1 LIQUID CRYSTAL ALIGNING AGENT AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2024-03-21 WO disclosed
WO-2023136269-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2023-07-20 WO disclosed
WO-2023085390-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2023-05-19 WO disclosed
US-20210371664-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL CORPORATION (JP) 2021-12-02 US disclosed
US-11111387-B2 Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2021-09-07 US disclosed
WO-2020145175-A1 LIQUID CRYSTAL ALIGNMENT AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学株式会社 2020-07-16 WO disclosed
US-20180244922-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2018-08-30 US disclosed
WO-1993003727-A1 USE OF CERTAIN XANTHINE DERIVATIVES AND THEIR PHARMACEUTICALLY ACCEPTABLE SALTS FOR THE MANUFACTURE OF A MEDICAMENT USEFUL FOR COUNTERACTING HYPOCLYCAEMIA NOVO NORDISK A/S (DK) 1993-03-04 WO disclosed
EP-0508549-A2 New triazolopyrimidine and pyrazolopyrimidine derivatives useful for treating cachexia SANKYO COMPANY LIMITED (JP) 1992-10-14 EP disclosed
US-5086057-A METHOD OF TREATING CACHEXIA AND CERTAIN NEW COMPOUNDS FOR USE IN THIS METHOD SANKYO COMPANY LIMITED (JP) 1992-02-04 US disclosed
US-5055479-A For enhancing activity of lipoprotein lipase enzymes SANKYO COMPANY, LIMITED (JP) 1991-10-08 US disclosed
EP-0347252-A2 Method of treating cachexia and certain new compounds for use in this method SANKYO COMPANY LIMITED (JP) 1989-12-20 EP disclosed
US-4808620-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIALLERGENS, ANTIARTHRITIC, ANTIRHEUMATIC AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1989-02-28 US disclosed
EP-0254241-A1 Pyrazolopyridine compounds, their preparation and use Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1988-01-27 EP disclosed
EP-0099438-A1 2-Functionalised diaryl as-triazines useful in therapy PIERRE FABRE S.A. (FR) 1984-02-01 EP disclosed
EP-0053681-A1 B-Nicotinoyloxyethyl nicotinic S-acid ester and its preparation via 2-Mercaptoethyl nicotinate Tauro, Celesio Sonnino (IT) 1982-06-16 EP disclosed