SCHEMBL3683010

SCHEMBL3683010

C=C(CC1COC(C)(C)O1)C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.42
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 1/20 0.35
TMEM97 Q5BJF2 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
NAMPT P43490 3/20 0.32
CA1 P00915 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30

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
SCHEMBL6674093 0.82 TMEM97 (0.43) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL22383092 0.81 ALDH1A1 (0.36) ALDH1A1
SCHEMBL4526320 0.80 CA2 (0.46) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL4528384 0.80 CA2 (0.46) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL4810847 0.80 ALDH1A1 (0.46) CA2ALDH1A1NPSR1TMEM97SIGMAR1
SCHEMBL674835 0.78 ALDH1A1 (0.47) ALDH1A1
Ammonia Solution, Strong SCHEMBL28108517 0.76 ALDH1A1 (0.46) ALDH1A1
Ethylene SCHEMBL28096383 0.76 ALDH1A1 (0.46) ALDH1A1
Methyl Alcohol SCHEMBL29284825 0.76 ALDH1A1 (0.46) ALDH1A1
SCHEMBL28122792 0.76 ALDH1A1 (0.46) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110139903-B Antifouling coating composition comprising novel carbon-based hydrolysable polymers 汉伯公司 2022-01-28 CN claimed
US-7645846-B2 Useful as monomer for the preparation of hemocompatible coating, medical device, water soluble polymer material, paint, water borne coating, or an ocular device (contact lenses) COOPERVISION INTERNATIONAL HOLDING COMPANY LP (BB) 2010-01-12 US claimed
CN-110139903-B Antifouling coating composition comprising novel carbon-based hydrolysable polymers 汉伯公司 2022-01-28 CN disclosed
CN-112368631-A Ophthalmic lens with photochromic coating and method for producing same 卡尔蔡司光学国际有限公司 2021-02-12 CN disclosed
CN-109997069-B Spectacle lens and method for producing the same 卡尔蔡司光学国际有限公司 2021-02-09 CN disclosed
WO-2016176146-A1 SURFACES COMPRISING ATTACHED QUORUM SENSING MODULATORS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 2016-11-03 WO disclosed
US-20160054300-A1 REFERENCE STANDARD FOR DIAGNOSTIC APPLICATIONS WINTHER LARS (DK) 2016-02-25 US disclosed
CN-101679197-B Method for producing diols COGNIS IP MAN GMBH 2013-08-14 CN disclosed
CN-101679197-A Method for producing diols COGNIS IP MAN GMBH 2010-03-24 CN disclosed
US-7645846-B2 Useful as monomer for the preparation of hemocompatible coating, medical device, water soluble polymer material, paint, water borne coating, or an ocular device (contact lenses) COOPERVISION INTERNATIONAL HOLDING COMPANY LP (BB) 2010-01-12 US disclosed
EP-1694494-A4 CONTACT LENSES AND PROCESSES FOR MANUFACTURING CONTACT LENSES MENICON CO LTD (JP) 2009-08-26 EP disclosed
EP-1171410-A1 PROCESS FOR THE PREPARATION OF A DIOL Hydron Limited (GB) 2002-01-16 EP disclosed
EP-1171411-A1 PROCESS FOR THE PREPARATION OF A DIOL Hydron Limited (GB) 2002-01-16 EP disclosed
WO-2001030559-A1 METHOD FOR THE PRODUCTION OF OPTHALMIC DEVICES HYDRON LIMITED (GB) 2001-05-03 WO disclosed
WO-2001004234-A1 METHOD OF STABILISING AN INVERSE LYOTROPIC LIQUID CRYSTALLINE PHASE IMPERIAL COLLEGE OF SCIENCE, TECHNOLOGY AND MEDICINE (GB) 2001-01-18 WO disclosed
WO-2000063150-A1 PROCESS FOR THE PREPARATION OF A DIOL HYDRON LIMITED (GB) 2000-10-26 WO disclosed
WO-2000063149-A1 PROCESS FOR THE PREPARATION OF A DIOL HYDRON LIMITED (GB) 2000-10-26 WO disclosed
EP-0243120-B1 TOUGH FLEXIBLE POLYMER BLENDS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1993-01-20 EP disclosed
US-5053276-A Computer storage disks, optical fibers ROHM GMBH CHEMISCHE FABRIK (DE) 1991-10-01 US disclosed
US-4985504-A STYRENE POLYMER, HETEROCYCLIC ACRYLATE POLYMER ROHM GMBH CHEMISCHE FABRIK (DE) 1991-01-15 US disclosed