SCHEMBL4052858

SCHEMBL4052858

N=C(N)c1conn1

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 SCHEMBL28312439 0.98
SCHEMBL27563605 0.70
SCHEMBL1231009 0.70
SCHEMBL27488323 0.68
SCHEMBL11597698 0.67
SCHEMBL7320440 0.67
SCHEMBL486333 0.62
SCHEMBL17866588 0.62 KDM4E (0.46)
SCHEMBL6827704 0.60
Hydrochloric Acid SCHEMBL27083191 0.60

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110461326-A Novel substituted N' -hydroxycarbamimidoyl-1, 2, 5-oxadiazole compounds as indoleamine 2, 3-dioxygenase (IDO) inhibitors MERCK SHARP & DOHME 2019-11-15 CN claimed
CN-106687450-B A kind of indoles amine -2,3- dioxygenase inhibitor and preparation method thereof 中国科学院上海有机化学研究所 2019-08-16 CN claimed
CN-109897011-A A kind of IDO inhibitor and its application 上海华汇拓医药科技有限公司 2019-06-18 CN claimed
EP-3389783-B1 NOVEL COMPOUNDS AS INDOLEAMINE 2,3-DIOXYGENASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2024-07-03 EP disclosed
CN-109422739-B Deuterated indoleamine 2, 3-dioxygenase inhibitor and application thereof 药捷安康(南京)科技股份有限公司 2022-07-12 CN disclosed
CN-110461326-A Novel substituted N' -hydroxycarbamimidoyl-1, 2, 5-oxadiazole compounds as indoleamine 2, 3-dioxygenase (IDO) inhibitors MERCK SHARP & DOHME 2019-11-15 CN disclosed
CN-110381963-A It is related to the immunotherapy method and composition of tryptophan metabolic pathway regulator 朱诺治疗学股份有限公司 2019-10-25 CN disclosed
CN-110357831-A A kind of crystal form and its salt of IDO inhibitor 江苏恒瑞医药股份有限公司 2019-10-22 CN disclosed
CN-110343098-A A kind of furodiazole compound and preparation method thereof, pharmaceutical composition and purposes 中国科学院上海药物研究所 2019-10-18 CN disclosed
EP-3544965-A1 SULFOXIMINE, SULFONIMIDAMIDE, SULFONDIIMINE AND DIIMIDOSULFONAMIDE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2, 3-DIOXYGENASE Shanghai Fochon Pharmaceutical Co., Ltd. (CN) 2019-10-02 EP disclosed
CN-110248931-A A kind of salt of dioxygenase inhibitor and its preparation method and application 上海翰森生物医药科技有限公司 2019-09-17 CN disclosed
CN-108727361-A Indole amine 2,3-dioxygenase inhibitor and application 南京药捷安康生物科技有限公司 2018-11-02 CN disclosed
CN-108473449-A Sulfonamidine as indoleamine-2, 3-dioxygenase inhibitor and preparation method and application thereof 上海长森药业有限公司 2018-08-31 CN disclosed
WO-2018095432-A1 SULFOXIMINE, SULFONIMIDAMIDE, SULFONDIIMINE AND DIIMIDOSULFONAMIDE COMPOUNDS AS INHIBITORS OF INDOLEAMINE 2, 3-DIOXYGENASE SHANGHAI FOCHON PHARMACEUTICAL CO., LTD. (CN) 2018-05-31 WO disclosed
CN-107954999-A Han oxadiazole rings compound, preparation method, intermediate, composition and application 上海医药集团股份有限公司 2018-04-24 CN disclosed
CN-107033097-A Oxadiazole analog derivative, its preparation method and its in application pharmaceutically 江苏恒瑞医药股份有限公司 2017-08-11 CN disclosed
CN-106565696-A Oxadiazole derivative, preparing method of oxadiazole derivative and application of oxadiazole derivative to medicines 江苏恒瑞医药股份有限公司 2017-04-19 CN disclosed
EP-1879573-A4 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORP (US) 2009-07-08 EP disclosed
EP-1879573-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-01-23 EP disclosed
WO-2006122150-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2006-11-16 WO disclosed