SCHEMBL16625933

SCHEMBL16625933

CCc1nnc(C)nn1

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
SCHEMBL17059097 0.75
SCHEMBL8755416 0.73 HSP90AA1 (0.31)
SCHEMBL8755276 0.73 HSP90AA1 (0.31)
SCHEMBL18119758 0.71
SCHEMBL21257038 0.71
SCHEMBL2614743 0.70 HRH4 (0.33)
SCHEMBL10074498 0.69
SCHEMBL10271455 0.67 KDM4E (0.42)
SCHEMBL22147437 0.67 KDM4E (0.32)
Hydrochloric Acid SCHEMBL28946231 0.65 HRH4 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3893872-B1 ORGANOPHOSPHORUS-SUBSTITUTED COMPOUNDS AS C-MET INHIBITORS AND THERAPEUTIC USES THEREOF BETA PHARMA INC (US) 2024-07-17 EP disclosed
WO-2022035997-A1 IN VIVO ASSEMBLY OF ASGPR BINDING THERAPEUTICS AVILAR THERAPEUTICS, INC. (US) 2022-02-17 WO disclosed
US-20210354133-A1 ENRICHMENT AND DEPLETION OF TARGET MOLECULES FOR SEQUENCING Quantum-Si Incorporated (US) 2021-11-18 US disclosed
US-20210331170-A1 TERMINAL FUNCTIONALIZATION OF TARGET MOLECULES FOR SEQUENCING Quantum-Si Incorporated (US) 2021-10-28 US disclosed
US-10696695-B2 BODIPY dyes for biological imaging THE GENERAL HOSPITAL CORPORATION (US) 2020-06-30 US disclosed
US-20190127394-A1 BODIPY DYES FOR BIOLOGICAL IMAGING THE GENERAL HOSPITAL CORPORATION 2019-05-02 US disclosed
US-20180214561-A1 EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2018-08-02 US disclosed
US-10005793-B2 Bodipy dyes for biological imaging THE GENERAL HOSPITAL CORPORATION (US) 2018-06-26 US disclosed
US-9902705-B2 Functionalized 1,2,4,5-tetrazine compounds for use in bioorthogonal coupling reactions THE GENERAL HOSPITAL CORPORATION (US) 2018-02-27 US disclosed
US-20170312363-A1 MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR XIAMEN SINOPEG BIOTECH CO., LTD. (CN) 2017-11-02 US disclosed
US-20170101384-A1 ANDROGEN RECEPTOR ANTAGONISTS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2017-04-13 US disclosed
US-9533957-B2 Tetrazines and method of synthezising the same THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-01-03 US disclosed
US-20160349268-A1 STEPWISE ASSEMBLED CAPTURE COMPOUNDS COMPRISING A CLEAVABLE FUNCTION AND METHOD FOR ISOLATING AND/OR CHARACTERIZING BIOMOLECULES OR BIOMOLECULE FRAGMENTS, IN PARTICULAR PROTEINS OR PROTEIN FRAGMENTS, OF COMPLEX MIXTURES CAPROTEC BIOANALYTICS GMBH (DE) 2016-12-01 US disclosed
US-20160287734-A1 18F LABELING OF PROTEINS USING SORTASES WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2016-10-06 US disclosed
US-20160149137-A1 CONDUCTIVE ORGANIC SEMICONDUCTOR COMPOUND, METHOD FOR PREPARING THE SAME AND ORGANIC THIN-FILM TRANSISTOR INCLUDING THE SAME KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2016-05-26 US disclosed
WO-2015196144-A2 ANDROGEN RECEPTOR ANTAGONISTS ENGLAND PAMELA M (US) 2015-12-23 WO disclosed
US-9133214-B2 Heteroalkyl linked pyrimidine derivatives S*BIO PTE LTD (SG) 2015-09-15 US disclosed
US-20150246893-A1 FUNCTIONALIZED 1,2,4,5-TETRAZINE COMPOUNDS FOR USE IN BIOORTHOGONAL COUPLING REACTIONS THE GENERAL HOSPITAL CORPORATION (US) 2015-09-03 US disclosed
US-20150099277-A1 NOVEL TETRAZINES AND METHOD OF SYNTHEZISING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-04-09 US disclosed