SCHEMBL6322980

SCHEMBL6322980

Nc1nc(=O)cc(Cl)[nH]1

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
SCHEMBL1321755 0.76
SCHEMBL11230182 0.74 CYP3A4 (0.42)
SCHEMBL190317 0.73
SCHEMBL908315 0.73
SCHEMBL12968317 0.73
SCHEMBL28729572 0.71 CYP3A4 (0.43)
SCHEMBL3723702 0.68 BACE1 (0.44)
SCHEMBL3724189 0.68 CYP3A4 (0.45)
SCHEMBL12192591 0.68 CYP3A4 (0.41)
SCHEMBL21597387 0.68 KDM4E (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912734-B2 Solid-phase synthesis of oligonucleotides containing N6-(2-deoxy-alpha,beta-derythropentofuranosyl)-2,6-diamino-4-hydroxy-5-formamidopyrimidine (Fapy⋅dG) THE JOHNS HOPKINS UNIVERSITY (US) 2024-02-27 US disclosed
US-20210238213-A1 SOLID-PHASE SYNTHESIS OF OLIGONUCLEOTIDES CONTAINING N6-(2-DEOXY-ALPHA,BETA-DERYTHROPENTOFURANOSYL)-2,6-DIAMINO-4-HYDROXY-5-FORMAMIDOPYRIMIDINE (Fapy.dG) THE JOHNS HOPKINS UNIVERSITY 2021-08-05 US disclosed
US-20120252791-A1 Heterocyclic GTP Cyclohydrolase 1 Inhibitors For the Treatment of Pain CHILDREN'S MEDICAL CENTER CORPORATION 2012-10-04 US disclosed
US-20120252791-A1 Heterocyclic GTP Cyclohydrolase 1 Inhibitors For the Treatment of Pain CHILDREN'S MEDICAL CENTER CORPORATION 2012-10-04 US disclosed
WO-2011035009-A1 HETEROCYCLIC GTP CYCLOHYDROLASE 1 INHIBITORS FOR THE TREATMENT OF PAIN HERCULES TECHNOLOGY MANAGEMENT CO V, INC. (US) 2011-03-24 WO disclosed
US-6870053-B2 Chloropyrimidine intermediates SMITHKLINE BEECHAM CORPORATION (US) 2005-03-22 US disclosed
US-20030187263-A1 Chloropvrimidine intermediates SMITHKLINE BEECHAM CORPORATION 2003-10-02 US disclosed
US-6555687-B1 N,N'-(4,6-dichloro-2,5-pyrimidinediyl)bisformamide as a chemical intermediate for 9-substituted-2-aminopurines, such as famciclovir and penciclovir; viricides; HIV and hepatitus virus SMITHKLINE BEECHAM CORPORATION 2003-04-29 US disclosed
US-6552193-B1 N-(2-Amino-4,6-dichloro-5-pyrimidinyl)formamide SMITHKLINE BEECHAM CORPORATION 2003-04-22 US disclosed
US-20020173649-A1 Chloropvrimidine intermediates SMITHKLINE BEECHAM CORPORATION 2002-11-21 US disclosed
US-6087501-A Chloropyrimidine intermediates and processes for their preparation GLAXO WELLCOME INC. (US) 2000-07-11 US disclosed
EP-0741710-B1 CHLOROPYRIMIDINE INTERMEDIATES WELLCOME FOUND (GB) 2000-05-10 EP disclosed
US-5917042-A Process for the preparation of 2,5-diamino-4,6-dichloropyrimidine GLAXO WELLCOME INC. (US) 1999-06-29 US disclosed
US-5917041-A Chloropyrimidine intermediates GLAXO WELLCOME INC. (US) 1999-06-29 US disclosed
EP-0741710-A1 CHLOROPYRIMIDE INTERMEDIATES THE WELLCOME FOUNDATION LIMITED (GB) 1996-11-13 EP disclosed
WO-1995021161-A1 CHLOROPYRIMIDE INTERMEDIATES THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 WO disclosed