SCHEMBL3067974

SCHEMBL3067974

C1=C\CCCC(N2CCC/C=N/CCC2)CCC/1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MBTD1 Q05BQ5 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
SCHEMBL5026092 1.00 L3MBTL3 (0.32) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Methyl Alcohol SCHEMBL29281740 0.95 KDM4E (0.31) L3MBTL3L3MBTL1KDM4ETDP1
SCHEMBL157634 0.91 KDM4E (0.34) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL157635 0.91 KDM4E (0.34) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Bromide SCHEMBL29250447 0.90 KDM4E (0.33) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL28479441 0.90 KDM4E (0.33) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Hydrochloric Acid SCHEMBL28987758 0.90 KDM4E (0.33) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
SCHEMBL21192477 0.89 SLC18A3 (0.38) L3MBTL3L3MBTL1KDM4E
Methyl Alcohol SCHEMBL28586250 0.87 KDM4E (0.35) L3MBTL3L3MBTL1KDM4ETDP1MBTD1
Methylene Chloride SCHEMBL29129857 0.86 KDM4E (0.34) L3MBTL3L3MBTL1KDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315710-B Method for preparing or purifying regorafenib 江苏豪森药业集团有限公司 2024-04-26 CN claimed
CN-114315710-A Method for preparing or purifying regorafenib 江苏豪森药业集团有限公司 2022-04-12 CN claimed
CN-113880883-A Nucleoside phosphate prodrug preparation method 奥锐特药业股份有限公司 2022-01-04 CN claimed
CN-107955333-B Reinforced and toughened epoxy resin composition 江南大学 2019-12-17 CN claimed
EP-3031800-B1 PROCESS FOR THE PREPARATION OF HIGH PURITY MIGLUSTAT NAVINTA LLC (US) 2019-07-31 EP claimed
EP-3404019-A1 PROCESS FOR THE PREPARATION OF HIGH PURITY MIGLUSTAT Navinta, llc. (US) 2018-11-21 EP claimed
US-9718777-B2 Process for the preparation of high purity miglustat NAVINTA, LLC (US) 2017-08-01 US claimed
US-9695111-B2 Method of producing soluble silicates with organic cations POLYMATE, LTD. (IL) 2017-07-04 US claimed
US-20170081274-A1 METHOD OF PRODUCING SOLUBLE SILICATES WITH ORGANIC CATIONS LIFSCHITZ, YAKOV MARK 2017-03-23 US claimed
US-20160168092-A1 Process For The Preparation Of High Purity Miglustat PROVIDENT BANK 2016-06-16 US claimed
EP-3031800-A1 PROCESS FOR THE PREPARATION OF HIGH PURITY MIGLUSTAT Navinta, llc. (US) 2016-06-15 EP claimed
WO-2006111712-A2 IONIC LIQUIDS AND USES THEREOF THE QUEEN'S UNIVERSITY OF BELFAST (GB) 2006-10-26 WO claimed
US-6486320-B2 CONVERGENT SYNTHESIS STARTING FROM A 3-(AMINOMETHYL)QUINOLINE DERIVATIVE AND 5-HYDROXY-5-ETHYL-6-OXO-5,6-DIHYDROPYRANCARBOXYLIC ACID AND THE INTERMEDIATES OBTAINED. AVENTIS PHARMA S.A. (FR) 2002-11-26 US claimed
US-6316618-B1 REACTING ETHYL 2-(4-CHLORO-5-FLUORO-2-HALO-3-NITOBENZOYL)-3-((1-HYDROXYPROPY-2(S) -YL)AMINO)ACRYLATE IN PRESENCE OF BASE, REACTING WITH PIPERIDINE COMPOUND, HYDROLYSIS, CYCLIZATION SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-11-13 US claimed
US-5304623-A Comprising a polyetherurethane, a vinyl polymer having pendant siloxy groups and a partially blocked solid polyisocyanate; adhesives; auto windshields; storage stability SUNSTAR GIKEN KABUSHIKI KAISHA (JP) 1994-04-19 US claimed
US-4874822-A REACTING AN ALKENYL AZLACTONE AND A HYDROXYL-CONTAINING COMPOUND OR POLYMER USING A BICYCLE AMIDINE OR TRIVALENT PHOSPHORUS COMPOUND BY PRODUCT INHIBITION MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1989-10-17 US claimed
US-4622407-A Resolution of racemic derivatives of 5-(1-methyl-5-methylthiopyrrol-2-oyl)-1,2-dihydro-3H-pyrrolo[1,2-a]pyrrole-2-carboxylic acid and analogs MERCK & CO., INC. (US) 1986-11-11 US claimed
US-4608407-A AMINE SALTS OF PHOSPHORUS-CONTAINING COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1986-08-26 US claimed
JP-3277620-A None JP disclosed
US-4594360-A Compound containing phenyl rings IOWA STATE UNIVERSITY RESEARCH FOUNDATION & INC. (US) 1986-06-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160168092-A1 Process For The Preparation Of High Purity Miglustat GANC, GANAB, GAA L3MBTL3 4585/4885L3MBTL1 4449/4885KDM4E 2175/4885
US-20170081274-A1 METHOD OF PRODUCING SOLUBLE SILICATES WITH ORGANIC CATIONS SOST, MTOR, AKT1 L3MBTL3 2540/4885L3MBTL1 3067/4885KDM4E 1583/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.