SCHEMBL9848158

SCHEMBL9848158

C[n+]1ccccc1Br

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
Bromide SCHEMBL9387001 0.97
Iodide SCHEMBL30213860 0.97
Perchlorate SCHEMBL11484878 0.91 HDAC8 (0.82)
Iodide SCHEMBL9364935 0.83 HDAC8 (0.69)
Trifluoromethanesulfonic Acid SCHEMBL320422 0.79 HDAC8 (0.62)
Trifluoromethanesulfonic Acid SCHEMBL31105615 0.79 HDAC8 (0.62)
SCHEMBL3719754 0.71 HDAC8 (0.55)
SCHEMBL329286 0.69
Hydrochloric Acid SCHEMBL5146726 0.69 HDAC8 (0.52)
SCHEMBL29561298 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1897901-B1 BIODEGRADABLE POLYMER, PRODUCTION METHOD THEREOF, MOLDED PRODUCT THEREOF, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2015-03-11 EP claimed
EP-3862431-B1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES TORAY INDUSTRIES (JP) 2024-06-26 EP disclosed
US-20240110186-A1 METHOD OF PRODUCING HAIRPIN SINGLE-STRANDED RNA MOLECULES TORAY INDUSTRIES, INC. (JP) 2024-04-04 US disclosed
US-11891602-B2 Method of producing hairpin single-stranded RNA molecules TORAY INDUSTRIES, INC. (JP) 2024-02-06 US disclosed
US-20230403927-A1 AROMATIC COMPOUNDS UDC IRELAND LTD (IE) 2023-12-14 US disclosed
US-20210317495-A1 METHOD OF PRODUCING HAIRPIN SINGLE-STRANDED RNA MOLECULES TORAY INDUSTRIES, INC. (JP) 2021-10-14 US disclosed
EP-3862431-A1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES Toray Industries, Inc. (JP) 2021-08-11 EP disclosed
CN-112673102-A Preparation method of hairpin type single-stranded RNA molecule 东丽株式会社 2021-04-16 CN disclosed
WO-2020071407-A1 METHOD FOR PRODUCING HAIRPIN SINGLE-STRAND RNA MOLECULES 東レ株式会社 2020-04-09 WO disclosed
CN-107253963-A Pyridone and azepine pyridinone compounds and application method 吉利德康涅狄格有限公司 2017-10-17 CN disclosed
CN-103038233-B Pyridone and azapyridone compounds and methods of use 吉利德康涅狄格有限公司 2017-06-20 CN disclosed
CN-105263935-A 6, 7-dihydropyrazolo [1,5-a ] pyrazin-4 (5H) -one compounds and their use as negative allosteric modulators of MGLUR2 receptors JANSSEN PHARMACEUTICA NV 2016-01-20 CN disclosed
EP-0459617-A1 Novel silicon containing alpha-cyanoacrylates THREE BOND CO., LTD. (JP) 1991-12-04 EP disclosed
EP-0436911-A2 Novel vitamin E derivatives and process for the production thereof Eisai Co., Ltd. (JP) 1991-07-17 EP disclosed
US-4206310-A Process for the preparation of esters SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1980-06-03 US disclosed