SCHEMBL4665496

SCHEMBL4665496

CC(CCO)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.51
MTNR1B P49286 1/20 0.51
TRPA1 O75762 1/20 0.44
LMNA P02545 1/20 0.44
ALDH1A1 P00352 1/20 0.43
RECQL P46063 1/20 0.43
LTA4H P09960 1/20 0.41
GPR88 Q9GZN0 1/20 0.41
SLC6A4 P31645 1/20 0.41
CYP1A2 P05177 1/20 0.39
GAA P10253 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39
CYP2C19 P33261 1/20 0.39
ABL1 P00519 2/20 0.39
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38
PPARG P37231 2/20 0.37
PPARA Q07869 2/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL2096011 0.88 MTNR1A (0.49) MTNR1AMTNR1BTRPA1LMNAALDH1A1
Sulfamate SCHEMBL9451369 0.88 MTNR1A (0.46) MTNR1AMTNR1BTRPA1LMNAGPR88
SCHEMBL7566883 0.83 MTNR1A (0.55) MTNR1AMTNR1BTRPA1LMNAALDH1A1
SCHEMBL6438883 0.83 ALDH1A1 (0.46) MTNR1AMTNR1BTRPA1LMNAALDH1A1
SCHEMBL120055 0.83 MTNR1A (0.55) MTNR1AMTNR1BTRPA1LMNAALDH1A1
SCHEMBL17892031 0.83 MTNR1A (0.55) MTNR1AMTNR1BTRPA1LMNAALDH1A1
SCHEMBL7973530 0.82 MTNR1A (0.53) MTNR1AMTNR1BLMNAALDH1A1SLC6A4
SCHEMBL19188889 0.82 ABL1 (0.41) MTNR1AMTNR1BLMNAALDH1A1ABL1
SCHEMBL1454240 0.81 MTNR1A (0.49) MTNR1AMTNR1BLMNAALDH1A1LTA4H
SCHEMBL25083791 0.80 SMN1; SMN2 (0.46) MTNR1AMTNR1BGPR88ABL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103936607-A Preparing method of bevantolol hydrochloride SHANGHAI HAINI PHARMACEUTICAL CO LTD YANGTZE RIVER PHARMACEUTICAL GROUP 2014-07-23 CN claimed
EP-3199367-A1 LITHOGRAPHIC PRINTING PLATE PRECURSOR, PROCESS FOR PRODUCING SAME, AND PRINTING METHOD USING SAME FUJI-FILM Corporation (JP) 2017-08-02 EP disclosed
EP-1846505-B1 SYNTHETIC SEALANTS COVIDIEN LP (US) 2015-11-11 EP disclosed
CN-103936607-A Preparing method of bevantolol hydrochloride SHANGHAI HAINI PHARMACEUTICAL CO LTD YANGTZE RIVER PHARMACEUTICAL GROUP 2014-07-23 CN disclosed
EP-2085439-A1 Photocurable composition, photocurable ink composition, process for producing photocured material, and inkjet recording method FUJIFILM Corporation (JP) 2009-08-05 EP disclosed
EP-1924570-A1 AZOLE AND THIAZOLE DERIVATIVES AND THEIR USE Argenta Discovery Limited (GB) 2008-05-28 EP disclosed
WO-2007017669-A1 AZOLE AND THIAZOLE DERIVATIVES AND THEIR USE ARGENTA DISCOVERY LTD. (GB) 2007-02-15 WO disclosed
US-6498278-B1 Alkoxylation of 6-membered alkylene carbonates HUNTSMAN PETROCHEMICAL CORPORATION 2002-12-24 US disclosed
EP-0970046-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS American Cyanamid Company (US) 2000-01-12 EP disclosed
WO-1998038163-A1 N-HYDROXY-2-(ALKYL, ARYL, OR HETEROARYL SULFANYL, SULFINYL OR SULFONYL)-3-SUBSTITUTED ALKYL, ARYL OR HETEROARYLAMIDES AS MATRIX METALLOPROTEINASE INHIBITORS AMERICAN CYANAMID COMPANY (US) 1998-09-03 WO disclosed
US-5273993-A Antiarthritic agents; osteoporosis A. H. ROBINS COMPANY, INCORPORATED (US) 1993-12-28 US disclosed
US-5194446-A Antiarthritic agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-03-16 US disclosed
US-5192785-A Sulfamates as antiglaucoma agents A. H. ROBINS COMPANY, INCORPORATED (US) 1993-03-09 US disclosed
US-5025031-A Aryl and aryloxyalkyl sulfamate esters useful as anticonvulsants A. H. ROBINS CO., INC. (US) 1991-06-18 US disclosed
EP-0403185-A2 Compounds having one or more aminosulfonyloxy radicals useful as pharmaceuticals A.H. ROBINS COMPANY, INCORPORATED (US) 1990-12-19 EP disclosed
US-4902811-A ANTIULCER AGENTS SHIONOGI & CO., LTD. (JP) 1990-02-20 US disclosed
EP-0297923-A1 Benzodioxane prostacyclin analogues, their preparation and use SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1989-01-04 EP disclosed