SCHEMBL1703801

SCHEMBL1703801

Nc1cncnc1C=O

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
SCHEMBL28678390 0.77
SCHEMBL9131053 0.74 ERN1 (0.36)
SCHEMBL14555815 0.73
SCHEMBL14484489 0.73
SCHEMBL29951683 0.73
SCHEMBL27977383 0.68 EGFR (0.33)
SCHEMBL28170829 0.68 HSP90AA1 (0.31)
SCHEMBL28056255 0.68 GRM4 (0.37)
SCHEMBL1703145 0.68
SCHEMBL311862 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260098018-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS INC (US) 2026-04-09 US disclosed
US-12441691-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof CYTOKINETICS, INC. (US) 2025-10-14 US disclosed
US-20240368091-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. 2024-11-07 US disclosed
US-11981644-B2 Bicyclic 1,4-diazepanones and therapeutic uses thereof CYTOKINETICS, INC. (US) 2024-05-14 US disclosed
EP-4240724-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF Cytokinetics, Inc. (US) 2023-09-13 EP disclosed
CN-116635378-A Bicyclic 1, 4-diazacycloheptanones and therapeutic uses thereof 赛特凯恩蒂克公司 2023-08-22 CN disclosed
US-20230083960-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. 2023-03-16 US disclosed
WO-2022099011-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. (US) 2022-05-12 WO disclosed
WO-2022099011-A1 BICYCLIC 1,4-DIAZEPANONES AND THERAPEUTIC USES THEREOF CYTOKINETICS, INC. (US) 2022-05-12 WO disclosed
EP-2427451-B1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CO LTD (JP) 2019-03-20 EP disclosed
US-9040531-B2 Alpha helix mimetics and methods relating thereto Prism BioLab Co., Ltd. (JP) 2015-05-26 US disclosed
WO-2014071298-A1 CYCLIC SULFONAMIDE CONTAINING DERIVATIVES AS INHIBITORS OF HEDGEHOG SIGNALING PATHWAY NANT HOLDINGS IP, LLC (US) 2014-05-08 WO disclosed
CN-101098855-B 3- [2- (3-amido-2-oxo-2H-pyridin-1-yl) -acetylamino ] -4-oxo-pentanoic acid derivatives and their use as caspase inhibitors VERTEX PHARMA 2012-06-06 CN disclosed
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 US disclosed
US-20120088770-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2012-04-12 US disclosed
WO-2010128685-A1 ALPHA HELIX MIMETICS AND METHODS RELATING THERETO PRISM BIOLAB CORPORATION (JP) 2010-11-11 WO disclosed
CN-101775012-A Aspartic acid specific cysteine proteinase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPO 2010-07-14 CN disclosed
CN-1812972-B Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPO 2010-04-28 CN disclosed
CN-101098855-A 3- [2- (3-amido-2-oxo-2H-pyridin-1-yl) -acetylamino ] -4-oxo-pentanoic acid derivatives and their use as caspase inhibitors VERTEX PHARMA (US) 2008-01-02 CN disclosed
CN-1812972-A Caspase inhibitors and uses thereof VERTEX PHARMACEUTICALS INCORPO (US) 2006-08-02 CN disclosed