SCHEMBL968195

SCHEMBL968195

O=[C]Nc1ncccn1

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
SCHEMBL1007992 0.76
SCHEMBL2852907 0.72
SCHEMBL2541201 0.72
SCHEMBL8495628 0.72
SCHEMBL588406 0.72 MAPK1 (0.37)
SCHEMBL80954 0.70
SCHEMBL28181288 0.67
SCHEMBL6039910 0.67 ALDH1A1 (0.54)
SCHEMBL5189119 0.67 ALDH1A1 (0.37)
SCHEMBL6589438 0.66 TRIM24 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2636669-B1 PYRAZOLE AMIDE COMPOUND AND USE THEREOF AS FUNGICIDE SINOCHEM CORP (CN) 2015-10-21 EP claimed
US-8614214-B2 Pyrazole amide compounds and uses thereof SINOCHEM CORPORATION (CN) 2013-12-24 US claimed
EP-2636669-A1 PYRAZOLE AMIDE COMPOUND AND USE THEREOF Sinochem Corporation (CN) 2013-09-11 EP claimed
US-20130225585-A1 PYRAZOLE AMIDE COMPOUNDS AND USES THEREOF SHENYANG RESEARCH INSTITUTE OF CHEMICAL INDUSTRY CO., LTD. (CN) 2013-08-29 US claimed
EP-1699497-A1 ANTIMICROBIAL CONTACT LENSES AND METHODS FOR THEIR PRODUCTION Johnson and Johnson Vision Care, Inc. (US) 2006-09-13 EP claimed
US-20050260249-A1 Antimicrobial contact lenses and methods for their production JOHNSON & JOHNSON VISION CARE, INC. 2005-11-24 US claimed
WO-2005065731-A1 ANTIMICROBIAL CONTACT LENSES AND METHODS FOR THEIR PRODUCTION JOHNSON & JOHNSON VISION CARE, INC. (US) 2005-07-21 WO claimed
US-20040213827-A1 Antimicrobial contact lenses and methods for their production JOHNSON & JOHNSON VISION CARE, INC. 2004-10-28 US claimed
US-6797820-B2 HYDROXAMATE DERIVATIVES THAT INHIBIT PEPTIDYL DEFORMYLASE (PDF), ANTIMICROBIALS AND ANTIBIOTICS VICURON PHARMACEUTICALS INC. 2004-09-28 US claimed
US-20040115242-A1 Antimicrobial contact lenses and methods for their production MEYERS ANN-MARIE W (US) 2004-06-17 US claimed
EP-1357949-A2 ANTIMICROBIAL CONTACT LENSES AND METHODS FOR THEIR PRODUCTION Johnson & Johnson Vision Care, Inc. (US) 2003-11-05 EP claimed
US-20030186976-A1 Benzofurylpyrone derivatives TEIJIN LIMITED, MICROBIAL CHEMISTRY RESEARCH FOUNDATION 2003-10-02 US claimed
US-20030044447-A1 Antimicrobial contact lenses and methods for their production JOHNSON & JOHNSON VISION CARE, INC. 2003-03-06 US claimed
EP-1237862-A1 SUCCINATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE AND PREPARATION Versicor, Inc. (US) 2002-09-11 EP claimed
US-20020115863-A1 Novel succinate compounds, compositions and methods of use and preparation VICURON HOLDINGS LLC 2002-08-22 US claimed
WO-2002049683-A2 ANTIMICROBIAL CONTACT LENSES AND METHODS FOR THEIR PRODUCTION JOHNSON & JOHNSON VISION CARE, INC. (US) 2002-06-27 WO claimed
WO-2001044179-A1 NOVEL SUCCINATE COMPOUNDS, COMPOSITIONS AND METHODS OF USE AND PREPARATION VERSICOR, INC. (US) 2001-06-21 WO claimed
EP-1063235-A1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LIMITED (JP) 2000-12-27 EP claimed
WO-1995003298-A1 BENZIMIDAZOLE DERIVATIVES USEFUL AS DOPAMINE RECEPTOR ANTAGONIST, 5-HT RECEPTOR AGONIST OR α1 RECEPTOR ANTAGONIST FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-02-02 WO claimed
EP-0157346-A2 Quinolizinone compound, processes for preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-10-09 EP claimed