SCHEMBL8561

SCHEMBL8561

NC(=O)c1nc(N)c[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
SCHEMBL780237 0.82
SCHEMBL3821371 0.79 LMNA (0.41)
SCHEMBL161337 0.77
SCHEMBL161336 0.77
Ribose (Furanose) SCHEMBL4576206 0.77 LMNA (0.42)
SCHEMBL7420813 0.77 HDAC6 (0.39)
SCHEMBL1857158 0.76
SCHEMBL4030743 0.74 LMNA (0.38)
SCHEMBL27627380 0.72 LMNA (0.36)
SCHEMBL1765849 0.72 GDA (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250082652-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES UNIVERSITÄT ZU KÖLN (DE) 2025-03-13 US claimed
EP-4460301-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES Universität zu Köln (DE) 2024-11-13 EP claimed
EP-3720493-B1 COMBINATIONS OF RIPK1- AND IKK-INHIBITORS FOR THE PREVENTION OR TREATMENT OF IMMUNE DISEASES UNIV KOELN (DE) 2024-07-24 EP claimed
WO-2023131576-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES UNIVERSITÄT ZU KÖLN (DE) 2023-07-13 WO claimed
EP-4209213-A1 SIGNALLING-PATHWAY INHIBITOR COMBINATIONS FOR USE IN THE TREATMENT OF CANCER DISEASES Universität zu Köln (DE) 2023-07-12 EP claimed
EP-2451794-B1 1,2,4-THIAZOLIDIN-3-ONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CANCER BALTIC BIO AB (SE) 2016-01-27 EP claimed
US-9162994-B2 1,2,4-thiazoloidin-3-one derivatives and their use in the treatment of cancer BETAGENON AB (SE) 2015-10-20 US claimed
US-20130196313-A1 Pharmacogenetic Method for Prediction of the Efficacy of Methotrexate Monotherapy in Recent-Onset Arthritis ACADEMISCH ZIEKENHUIS H.O.D.N. LUMC (NL) 2013-08-01 US claimed
US-20130143215-A1 Methods of Predicting Methotrexate Efficacy and Toxicity PROMETHEUS LABORATORIES INC. (US) 2013-06-06 US claimed
WO-2013076160-A1 SUSTAINED RELEASE FORMULATIONS USEFUL IN THE TREATMENT OF DISEASES Université Libre de Bruxelles (BE) 2013-05-30 WO claimed
WO-2006116684-A2 METHODS OF PREDICTING METHOTREXATE EFFICACY AND TOXICITY PROMETHEUS LABORATORIES, INC. (US) 2006-11-02 WO claimed
EP-1668337-A2 METHODS FOR OPTIMIZING CLINICAL RESPONSIVENESS TO METHOTREXATE THERAPY USING METABOLITE PROFILING AND PHARMACOGENETICS Prometheus Laboratories, Inc. (US) 2006-06-14 EP claimed
EP-1495006-A4 INHIBITORS OF GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE SCRIPPS RESEARCH INST (US) 2006-05-10 EP claimed
US-20050112627-A1 Methods for optimizing clinical responsiveness to methotrexate therapy using metabolite profiling and pharmacogenetics PROMETHEUS LABORATORIES INC. (US) 2005-05-26 US claimed
WO-2005022118-A2 METHODS FOR OPTIMIZING CLINICAL RESPONSIVENESS TO METHOTREXATE THERAPY USING METABOLITE PROFILING AND PHARMACOGENETICS PROMETHEUS LABORATORIES, INC. (US) 2005-03-10 WO claimed
EP-1495006-A1 INHIBITORS OF GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE The Scripps Research Institute (US) 2005-01-12 EP claimed
US-20040156826-A1 Treatment of patients with multiple sclerosis based on gene expression changes in central nervous system tissues BRIGHAM AND WOMEN'S HOSPITAL, INC., THE 2004-08-12 US claimed
WO-2004028339-A2 TREATMENT OF PATIENTS WITH MULTIPLE SCLEROSIS BASED ON GENE EXPRESSION CHANGES IN CENTRAL NERVOUS SYSTEM TISSUES BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2004-04-08 WO claimed
WO-2003087065-A1 INHIBITORS OF GLYCINAMIDE RIBONUCLEOTIDE TRANSFORMYLASE THE SCRIPPS RESEARCH INSTITUTE (US) 2003-10-23 WO claimed
US-20030166201-A1 Selection systems for genetically modified cells CITY OF HOPE 2003-09-04 US claimed