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) —
SCHEMBL1765849 0.72 GDA (0.34) —
SCHEMBL27627380 0.72 LMNA (0.36) —

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
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