SCHEMBL1261985

SCHEMBL1261985

N=C(N)c1ccco1

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
Hydrochloric Acid SCHEMBL497084 0.98
Hydrochloric Acid SCHEMBL5731095 0.98 CES2 (0.50)
Trifluoroacetic Acid SCHEMBL27525350 0.83 PTPN1 (0.47)
SCHEMBL30745655 0.77
SCHEMBL3085514 0.77
SCHEMBL60741 0.75
SCHEMBL20201090 0.75
SCHEMBL12390569 0.75
SCHEMBL17056191 0.75
SCHEMBL27554912 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100347164-C Benzofuryl derivatives and their use HOFMMANN LA ROCHE AG F (CH) 2007-11-07 CN claimed
CN-1935797-A Bichalcophenes and prodrugs thereof as antiprotozoal agents UNIV NORTH CAROLINA (US) 2007-03-28 CN claimed
CN-1914188-A Cationic substituted benzofurans as antimicrobial agents UNIV NORTH CAROLINA (US) 2007-02-14 CN claimed
EP-0724435-B1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS SEARLE & CO (US) 2002-08-14 EP claimed
CN-1217720-A Benzofuryl derivatives and their use HOFMMANN LA ROCHE (CH) 1999-05-26 CN claimed
US-5821267-A MODULATING THE INDUCIBLE ISOFORM OVER THE CONSTITUTIVE; HYPERTENSIVE, ANTIARTHRITIC AND DIABETIC AGENTS; THERAPY WITH CYTOKINES; TOXIC AND SEPTIC SHOCK G.D. SEARLE & CO. (US) 1998-10-13 US claimed
EP-0724435-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1996-08-07 EP claimed
WO-1995011014-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1995-04-27 WO claimed
US-12371422-B2 Fluorine-containing pyrimidine compound and manufacturing method for same UNIMATEC CO., LTD. (JP) 2025-07-29 US disclosed
US-20240317705-A1 POTASSIUM CHANNEL MODULATORS NOVARTIS AG (CH) 2024-09-26 US disclosed
US-20240150329-A1 FLUORINE-CONTAINING PYRIMIDINE COMPOUND AND MANUFACTURING METHOD FOR SAME UNIMATEC CO., LTD. (JP) 2024-05-09 US disclosed
CN-115335524-A RNA for complement inhibition 阿佩利斯制药有限公司 2022-11-11 CN disclosed
EP-4052759-A1 FLUORINE-CONTAINING PYRIMIDINE COMPOUND AND MANUFACTURING METHOD FOR SAME Unimatec Co., Ltd. (JP) 2022-09-07 EP disclosed
CN-114585618-A Fluorine-containing pyrimidine compound and method for producing same 优迈特株式会社 2022-06-03 CN disclosed
EP-0724435-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1996-08-07 EP disclosed
EP-0713483-A1 AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES Astra Aktiebolag (SE) 1996-05-29 EP disclosed
WO-1995011014-A1 AMIDINO DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS G.D. SEARLE & CO. (US) 1995-04-27 WO disclosed
WO-1995005363-A1 AMIDINE DERIVATIVES WITH NITRIC OXIDE SYNTHETASE ACTIVITIES ASTRA AKTIEBOLAG (SE) 1995-02-23 WO disclosed
US-4713383-A ADENOSINE AND BENZODIAZEPINE ANTAGONISTS CIBA-GEIGY CORPORATION (US) 1987-12-15 US disclosed
EP-0181282-A1 Triazoloquinazoline compounds CIBA-GEIGY AG (CH) 1986-05-14 EP disclosed