SCHEMBL714532

SCHEMBL714532

CCCOc1ccc2ccccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
MAPK1 P28482 1/20 0.68
AGXT P21549 2/20 0.59
RAB9A P51151 4/20 0.58
NPC1 O15118 3/20 0.58
MAPT P10636 2/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALOX5 P09917 1/20 0.55
DRD3 P35462 1/20 0.54
HRH3 Q9Y5N1 1/20 0.54
ALDH1A1 P00352 1/20 0.54
GPBAR1 Q8TDU6 1/20 0.54
CYSLTR1 Q9Y271 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2A6 P11509 1/20 0.54
PPARG P37231 2/20 0.53
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 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
Ammonia Solution, Strong SCHEMBL7212066 0.98 KDM4E (0.66) KDM4ETDP1MAPK1AGXTRAB9A
Methane SCHEMBL27919188 0.96 KDM4E (0.63) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL29666114 0.92 TDP1 (0.68) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL470925 0.92 TDP1 (0.68) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL15772419 0.91 CA12 (0.56) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL22325684 0.91 CA12 (0.59) KDM4ETDP1MAPK1MAPTGPBAR1
SCHEMBL20110895 0.89 KDM4E (0.82) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL13196822 0.89 KDM4E (0.82) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL9576090 0.88 KDM4E (0.63) KDM4ETDP1MAPK1AGXTRAB9A
SCHEMBL23458236 0.87 CA12 (0.56) KDM4ETDP1MAPK1MAPTGPBAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108689809-A A kind of clean preparation method of bromelia and application 盐城市东港药物化工发展有限公司 2018-10-23 CN claimed
CN-101574646-B Lipase bonded stationary phase and preparation method and use thereof UNIV CHINA AGRICULTURAL 2011-07-20 CN claimed
CN-101574646-A Lipase bonded stationary phase and preparation method and use thereof UNIV CHINA AGRICULTURAL (CN) 2009-11-11 CN claimed
US-6680281-B2 Heat-sensitive recording material OJI PAPER CO., LTD. (JP) 2004-01-20 US claimed
CN-111886274-B Alkali-soluble resin containing unsaturated group, photosensitive resin composition containing the same as essential component, and cured product thereof 日铁化学材料株式会社 2024-01-09 CN disclosed
CN-114534787-B Gas-phase dehydrogenation catalyst and method for isopentenol 万华化学集团股份有限公司 2023-12-19 CN disclosed
US-11840015-B2 Composition for optical three-dimensional shaping, three-dimensionally shaped article, and method for producing same OKAMOTO CHEMICAL INDUSTRY CO., LTD. (JP) 2023-12-12 US disclosed
EP-3904414-B1 COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, THREE-DIMENSIONALLY SHAPED ARTICLE, AND METHOD FOR PRODUCING SAME OKAMOTO CHEMICAL IND CO LTD (JP) 2023-12-06 EP disclosed
CN-116783070-A Composite structure, laminated ceramic electronic component precursor, method for producing laminated ceramic electronic component precursor, and method for producing laminated ceramic electronic component 株式会社村田制作所 2023-09-19 CN disclosed
CN-112334319-B Heat-sensitive recording material 王子控股株式会社 2023-02-10 CN disclosed
EP-3904414-A1 COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, THREE-DIMENSIONALLY SHAPED ARTICLE, AND METHOD FOR PRODUCING SAME Okamoto Chemical Industry Co., Ltd. (JP) 2021-11-03 EP disclosed
US-20210229344-A1 COMPOSITION FOR OPTICAL THREE-DIMENSIONAL SHAPING, THREE-DIMENSIONALLY SHAPED ARTICLE, AND METHOD FOR PRODUCING SAME OKAMOTO CHEMICAL INDUSTRY CO., LTD. (JP) 2021-07-29 US disclosed
EP-0459495-A2 Process for the acylation of naphthylethers with the aid of zeolite-catalysts HOECHST AKTIENGESELLSCHAFT (DE) 1991-12-04 EP disclosed
US-5021413-A Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed
CN-1040791-A ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES SANKYO CO (JP) 1990-03-28 CN disclosed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP disclosed
EP-0313559-A1 PROCESS FOR THE PRODUCTION OF ALDEHYDES BY HYDROFORMYLATION. DAVY MCKEE LONDON (GB) 1989-05-03 EP disclosed
CN-87104616-A Process for the preparation of a catalyst 1988-01-27 CN disclosed
EP-0196805-A1 Acylation of naphthalenes CELANESE CORPORATION (US) 1986-10-08 EP disclosed
US-4593125-A In anhydrous hydrogen fluoride CELANESE CORPORATION (US) 1986-06-03 US disclosed