SCHEMBL336262

SCHEMBL336262

O=[N+]([O-])c1ccc(N2CCNCC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT6 Q8N6T7 2/20 1.00
ADRB1 P08588 1/20 1.00
MAPT P10636 4/20 0.68
HTR7 P34969 2/20 0.66
HTR1A P08908 1/20 0.66
ALDH1A1 P00352 2/20 0.64
POLB P06746 2/20 0.64
RECQL P46063 1/20 0.58
LMNA P02545 2/20 0.57
KCNJ1 P48048 1/20 0.55
KCNH2 Q12809 1/20 0.55
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.54
CRBN Q96SW2 1/20 0.54

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
SCHEMBL7526992 1.00 SIRT6 (1.00) SIRT6ADRB1MAPTHTR7HTR1A
Hydrochloric Acid SCHEMBL1814630 0.98 SIRT6 (0.96) SIRT6ADRB1MAPTHTR7HTR1A
Hydrogen Sulfide SCHEMBL28002215 0.98 SIRT6 (0.96) SIRT6ADRB1MAPTHTR7HTR1A
SCHEMBL6152151 0.98 SIRT6 (0.96) SIRT6ADRB1MAPTHTR7HTR1A
SCHEMBL6151805 0.98 SIRT6 (0.96) SIRT6ADRB1MAPTHTR7HTR1A
SCHEMBL1496058 0.98 SIRT6 (0.96) SIRT6ADRB1MAPTHTR7HTR1A
SCHEMBL27980887 0.95 SIRT6 (0.90) SIRT6ADRB1MAPTHTR7HTR1A
SCHEMBL942183 0.93 SIRT6 (0.87) SIRT6ADRB1MAPTHTR7HTR1A
Hydrochloric Acid SCHEMBL7984519 0.92 SIRT6 (0.84) SIRT6ADRB1MAPTHTR7HTR1A
Propane SCHEMBL27412411 0.92 SIRT6 (0.84) SIRT6ADRB1MAPTHTR7HTR1A

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 1777 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118666760-A Nitrogen-heterocycle-containing alpha-carbonyl thioamide compound, and preparation method and application thereof 浙大城市学院 2024-09-20 CN claimed
EP-3906235-B1 METHOD FOR PREPARING SULFONAMIDES DRUGS ASCENTAGE PHARMA SUZHOU CO LTD (CN) 2023-03-15 EP claimed
US-11414400-B2 Method for preparing sulfonamides drugs ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) 2022-08-16 US claimed
CN-112679445-B Preparation method of posaconazole intermediate 成都圣诺生物制药有限公司 2022-07-05 CN claimed
US-11261282-B2 PEO-PPO-PEO triblock bipolymers, with amphoteric endings, as demulsifying agents for heavy crude oils INSTITUTO MEXICANO DEL PETROLEO (MX) 2022-03-01 US claimed
US-20210221788-A1 METHOD FOR PREPARING SULFONAMIDES DRUGS ASCENTAGE PHARMA GROUP CORP LIMITED (CN) 2021-07-22 US claimed
CN-112679445-A Preparation method of posaconazole intermediate 成都圣诺生物制药有限公司 2021-04-20 CN claimed
CN-111410650-B Process for the preparation of sulfonamides 苏州亚盛药业有限公司 2020-12-08 CN claimed
US-20200347173-A1 PEO-PPO-PEO TRIBLOCK BIPOLYMERS, WITH AMPHOTERIC ENDINGS, AS DEMULSIFYING AGENTS FOR HEAVY CRUDE OILS INSTITUTO MEXICANO DEL PETROLEO (MX) 2020-11-05 US claimed
CN-111410650-A Process for the preparation of sulfonamides 苏州亚盛药业有限公司 2020-07-14 CN claimed
EP-2135313-B1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES CO (US) 2011-09-14 EP claimed
EP-2135313-A1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M Innovative Properties Company (US) 2009-12-23 EP claimed
WO-2008127828-A1 HIGH PERFORMANCE, HIGH DURABILITY NON-PRECIOUS METAL FUEL CELL CATALYSTS 3M INNOVATIVE PROPERTIES COMPANY (US) 2008-10-23 WO claimed
CN-1257896-C Funcitonal molecule material containing four tertiary amine branches and preparation method UNIV FUDAN (CN) 2006-05-31 CN claimed
CN-1539833-A Funcitonal molecule material containing four tertiary amine branches and preparation method 复旦大学 2004-10-27 CN claimed
EP-0500050-B1 Non-linear optical materials, method of manufacturing the same and optical wave length converter MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 1995-12-27 EP claimed
US-5460754-A Non-linear optical material, method of manufacturing the same and optical wavelength converter MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1995-10-24 US claimed
US-5346653-A Non-linear optical material, method of manufacturing the same and optical wavelength converter MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1994-09-13 US claimed
EP-0539180-A1 Antiviral agents SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 1993-04-28 EP claimed
EP-0500050-A2 Non-linear optical materials, method of manufacturing the same and optical wave length converter MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1992-08-26 EP claimed

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-11414400-B2 Method for preparing sulfonamides drugs BCL2, BCL3, BAK1 SIRT6 766/4885ADRB1 3974/4885MAPT 4071/4885
US-20210221788-A1 METHOD FOR PREPARING SULFONAMIDES DRUGS BCL2, BCL3, BAK1 SIRT6 766/4885ADRB1 3974/4885MAPT 4071/4885

“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.