SCHEMBL901706

SCHEMBL901706

N[n+]1cccc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.46
BCHE P06276 13/20 0.46

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
Hydroxyamine SCHEMBL4937262 0.69 ACHE (0.48) ACHEBCHE
SCHEMBL2058677 0.69 ACHE (0.47) ACHEBCHE
SCHEMBL1665979 0.68 ACHE (0.46) ACHEBCHE
SCHEMBL8724092 0.68 ACHE (0.46) ACHEBCHE
SCHEMBL29752612 0.68 ACHE (0.53) ACHEBCHE
SCHEMBL3861730 0.68 ACHE (0.46) ACHEBCHE
SCHEMBL4824142 0.68 ACHE (0.46) ACHEBCHE
SCHEMBL7111378 0.68 ACHE (0.46) ACHEBCHE
SCHEMBL307903 0.68 ACHE (0.53) ACHEBCHE
SCHEMBL5187065 0.68 ACHE (0.46) ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012041493-A1 AMINOQUINOLINIUM SALTS, METHODS OF THEIR PRODUCTION AND THEIR USE AS ACTIVE AGENTS FOR BIOTECHNOLOGICAL AND MEDICAL APPLICATIONS AGAINST BINARY TOXINS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2012-04-05 WO claimed
US-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents PALUMED S.A. (FR) 2007-03-15 US claimed
US-20200261340-A1 CATIONIC DIRECT DYE COMPRISING AN ALIPHATIC CHAIN AND BEARING A DISULFIDE/THIOL/PROTECTED-THIOL FUNCTION FOR DYEING KERATIN FIBRES L'OREAL (FR) 2020-08-20 US disclosed
EP-3373902-B1 CATIONIC DIRECT DYE COMPRISING AN ALIPHATIC CHAIN AND BEARING A DISULFIDE/THIOL/PROTECTED-THIOL FUNCTION FOR DYEING KERATIN FIBRES OREAL (FR) 2020-04-29 EP disclosed
EP-3373902-A1 CATIONIC DIRECT DYE COMPRISING AN ALIPHATIC CHAIN AND BEARING A DISULFIDE/THIOL/PROTECTED-THIOL FUNCTION FOR DYEING KERATIN FIBRES L'Oréal (FR) 2018-09-19 EP disclosed
WO-2017081314-A1 CATIONIC DIRECT DYE COMPRISING AN ALIPHATIC CHAIN AND BEARING A DISULFIDE/THIOL/PROTECTED-THIOL FUNCTION FOR DYEING KERATIN FIBRES L'OREAL (FR) 2017-05-18 WO disclosed
WO-2012041493-A1 AMINOQUINOLINIUM SALTS, METHODS OF THEIR PRODUCTION AND THEIR USE AS ACTIVE AGENTS FOR BIOTECHNOLOGICAL AND MEDICAL APPLICATIONS AGAINST BINARY TOXINS JULIUS-MAXIMILIANS-UNIVERSITÄT WÜRZBURG (DE) 2012-04-05 WO disclosed
US-20090307791-A1 CALCIUM-ACTIVATED CHLORIDE CHANNEL AND METHODS OF USE THEREOF NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-12-10 US disclosed
US-7553477-B2 Zeolitic microporous crystalline material with an LTA structure (ITQ-29), preparation method thereof and uses of same in organic compound separation and transformation processes CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (ES) 2009-06-30 US disclosed
US-20070098629-A1 Zeolitic microporous crystalline material with an LTA structure (ITQ-29), preparation method thereof and uses of same in organic compound separation and transformation processes UNIVERSIDAD POLITECNICA DE VALENCIA (ES) 2007-05-03 US disclosed
US-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents PALUMED S.A. (FR) 2007-03-15 US disclosed
EP-1736441-A1 ZEOLITIC MICROPOROUS CRYSTALLINE MATERIAL WITH AN LTA STRUCTURE (ITQ-29), PREPARATION METHOD THEREOF AND USES OF SAME IN ORGANIC COMPOUND SEPARATION AND TRANSFORMATION PROCESSES Consejo Superior de Investigaciones Cientificas (ES) 2006-12-27 EP 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-20200261340-A1 CATIONIC DIRECT DYE COMPRISING AN ALIPHATIC CHAIN AND BEARING A DISULFIDE/THIOL/PROTECTED-THIOL FUNCTION FOR DYEING KERATIN FIBRES KRT18, TST, PDIA5 ACHE 3104/4885BCHE 4370/4885
US-20070060558-A1 Hybrid molecules QA where Q is an aminoquinoline and A is an antibiotic residue, the synthesis and uses thereof as antibacterial agents QARS1, QPCT, QTRT2 ACHE 2296/4885BCHE 2649/4885

“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.