SCHEMBL486829

SCHEMBL486829

CC(C)C[Al](O)CC(C)C

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38

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
SCHEMBL31081585 0.69 TSHR (0.38) TSHR
SCHEMBL3819026 0.67 TSHR (0.33) TSHR
SCHEMBL15141 0.67 TSHR (0.33) TSHR
Methyl Alcohol SCHEMBL28674412 0.67
Methyl Alcohol SCHEMBL28536398 0.67 TSHR (0.35) TSHR
Hydrochloric Acid SCHEMBL11650945 0.67 TSHR (0.35) TSHR
Methyl Alcohol SCHEMBL9490486 0.67 TSHR (0.35) TSHR
Methyl Alcohol SCHEMBL28412835 0.67 TSHR (0.35) TSHR
SCHEMBL212871 0.65
SCHEMBL728051 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118619865-A Preparation method of diisoisothiocyanate 四川国和新材料有限公司 2024-09-10 CN claimed
US-5374744-A Sex pheronome of Japanese beetle, cupreous chafers; oxidation, reduction, cleavage, cyclization, alkynylation, hydrolysis JAPAN TOBACCO INC. (JP) 1994-12-20 US claimed
CN-118619865-B Preparation method of diisoisothiocyanate 四川国和新材料有限公司 2024-12-24 CN disclosed
CN-118619865-A Preparation method of diisoisothiocyanate 四川国和新材料有限公司 2024-09-10 CN disclosed
CN-113072551-B Nitrogen-containing biphenyl derivative inhibitor, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-08-13 CN disclosed
CN-111542939-A Organic semiconductor element, organic semiconductor composition, organic semiconductor film, method for producing organic semiconductor film, and polymer for use in these 富士胶片株式会社 2020-08-14 CN disclosed
CN-106478496-A Dihydropyridine sulfonamide and dihydropyridine sulphamide as mek inhibitor 阿迪生物科学公司 2017-03-08 CN disclosed
EP-2411366-B1 DIHYDROPYRIDIN SULFONAMIDES AND DIHYDROPYRIDIN SULFAMIDES AS MEK INHIBITORS ARDEA BIOSCIENCES INC (US) 2015-05-20 EP disclosed
US-8993630-B2 Substituted sulphonamido phenoxybenzamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-03-31 US disclosed
US-8962606-B2 Substituted benzosulphonamides BAYER INTELLECTUAL PROPERTY GMBH (US) 2015-02-24 US disclosed
US-8673919-B2 Dihydropyridin sulfonamides and dihydropyridin sulfamides as MEK inhibitors ARDEA BIOSCIENCES, INC. (US) 2014-03-18 US disclosed
WO-2008138639-A1 SUBSTITUTED PHENYLAMINO-BENZENE DERIVATIVES USEFUL FOR TREATING HYPER-PROLIFERATIVE DISORDERS AND DISEASES ASSOCIATED WITH MITOGEN EXTRACELLULAR KINASE ACTIVITY BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-11-20 WO disclosed
EP-1414809-B1 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION BAYER CORP (US) 2008-03-12 EP disclosed
WO-2006012577-A2 QUINAZOLINONE DERIVATIVES USEFUL FOR THE REGULATION OF GLUCOSE HOMEOSTASIS AND FOOD INTAKE BAYER PHARMACEUTICALS CORPORATION (US) 2006-02-02 WO disclosed
WO-2003030909-A1 2- AND 4-AMINOPYRIMIDINES N-SUBSTTITUDED BY A BICYCLIC RING FOR USE AS KINASE INHIBITORS IN THE TREATMENT OF CANCER BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-17 WO disclosed
CN-1245773-A Process for producing chlorine SUMITOMO CHEMICAL CO (JP) 2000-03-01 CN disclosed
EP-0528044-B1 Process for producing 4-substituted gamma- lactone, and the so produced novel substances. JAPAN TOBACCO INC (JP) 1997-08-13 EP disclosed
US-5374744-A Sex pheronome of Japanese beetle, cupreous chafers; oxidation, reduction, cleavage, cyclization, alkynylation, hydrolysis JAPAN TOBACCO INC. (JP) 1994-12-20 US disclosed
EP-0528044-A1 PROCESS FOR PRODUCING 4-SUBSTITUTED $g(g)-LACTONE, AND NOVEL SUBSTANCE JAPAN TOBACCO INC. (JP) 1993-02-24 EP disclosed
US-4304907-A Bicyclo lactone intermediates for prostaglandin analogs THE UPJOHN COMPANY (US) 1981-12-08 US disclosed