SCHEMBL3912844

SCHEMBL3912844

N=C(N)Nn1cccn1

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
Hydrochloric Acid SCHEMBL28556948 0.98 NOS1 (0.47)
SCHEMBL4517927 0.78
SCHEMBL402280 0.78
SCHEMBL4517923 0.74
SCHEMBL8545489 0.71
SCHEMBL9601627 0.71
SCHEMBL3918994 0.71 NOS1 (0.33)
SCHEMBL3983133 0.70 NOS1 (0.32)
SCHEMBL3912744 0.70
Hydrochloric Acid SCHEMBL4755774 0.70 ELANE (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115772132-A Amidine/guanidino modified fungal CYP51 inhibitor derivative, and preparation method and application thereof 山东大学 2023-03-10 CN claimed
CN-111269149-B Production process of 5- (3,3-dimethylguanidino) -2-oxopentanoic acid 南京优氟医药科技有限公司 2022-04-15 CN claimed
WO-2025119337-A1 ANTIVIRAL CONJUGATE 苏州拓界医药有限公司 2025-06-12 WO disclosed
WO-2025103493-A1 CANNABINOID RECEPTOR 1 ANTAGONIST AND USE THEREOF 西藏海思科制药有限公司 2025-05-22 WO disclosed
WO-2025002421-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTION AND USE THEREOF 上海爱科百发生物医药技术股份有限公司 2025-01-02 WO disclosed
WO-2023125806-A1 CONJUGATE FOR PREVENTING AND TREATING VIRAL INFECTIONS AND USE THEREOF 苏州爱科百发生物医药技术有限公司 2023-07-06 WO disclosed
CN-115894617-A Polypeptide compound and application thereof 成都诺和晟泰生物科技有限公司 2023-04-04 CN disclosed
CN-115772132-A Amidine/guanidino modified fungal CYP51 inhibitor derivative, and preparation method and application thereof 山东大学 2023-03-10 CN disclosed
CN-111662232-B Small molecule compound with 2H-indazole structure and synthesis and application thereof 中国科学院上海药物研究所 2022-08-02 CN disclosed
CN-114746418-A Monocyclic beta-lactam compounds and uses thereof 苏州信诺维医药科技股份有限公司 2022-07-12 CN disclosed
CN-112175042-B Method for synthesizing Etelcalcetide 深圳翰宇药业股份有限公司 2022-05-31 CN disclosed
CN-107573275-A Cinnamamide derivative 日本脏器制药株式会社 2018-01-12 CN disclosed
CN-103476252-B Pyrazolyl guanidine F1F 0-ATPase inhibitors and therapeutic uses thereof 莱斯拉公司 2017-02-22 CN disclosed
US-9540338-B2 Substituted cinnamic acid amides for treating pain NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2017-01-10 US disclosed
US-20150322024-A1 Cinnamic Acid Amide Derivative NIPPON ZOKI PHARMACEUTICAL CO., LTD. (JP) 2015-11-12 US disclosed
EP-2940003-A1 CINNAMIC ACID AMIDE DERIVATIVE Nippon Zoki Pharmaceutical Co., Ltd. (JP) 2015-11-04 EP disclosed
CN-104884426-A Cinnamide derivative NIPPON ZOKI PHARMACEUCTICAL CO LTD 2015-09-02 CN disclosed
CN-103476252-A Pyrazolyl guanidines F1F0Inhibitors of ATPase and therapeutic uses thereof LYCERA CORP 2013-12-25 CN disclosed
EP-2026754-A2 LIGHTENING AND/OR COLOURING AGENT COMPRISING CYCLIC UREA DERIVATIVES Henkel AG & Co. KGaA (DE) 2009-02-25 EP disclosed
WO-2007137676-A2 LIGHTENING AND/OR COLOURING AGENT COMPRISING CYCLIC UREA DERIVATIVES HENKEL AG & CO. KGAA (DE) 2007-12-06 WO disclosed