SCHEMBL4721832

SCHEMBL4721832

CN(C)C(=O)CCC=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
SCHEMBL5329563 0.85 ALDH1A1 (0.56)
SCHEMBL2077373 0.83 ALDH1A1 (0.54)
Hydrochloric Acid SCHEMBL27936402 0.83 ALDH1A1 (0.54)
SCHEMBL5664501 0.82
SCHEMBL28774714 0.81 ALDH1A1 (0.52)
SCHEMBL7301068 0.81 ALDH1A1 (0.50)
SCHEMBL19192933 0.80
SCHEMBL26250211 0.80
SCHEMBL18656542 0.80
Hydrochloric Acid SCHEMBL8975960 0.80 ALDH1A1 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118265709-A Tetrahydroisoquinoline compounds as KEAP1 binders 希四克斯探索有限公司 2024-06-28 CN claimed
CN-111448190-B Substituted indole compounds 百时美施贵宝公司 2023-09-26 CN claimed
CN-109715617-B Dimethoxyphenyl-substituted indole compounds as inhibitors of TLR7, TLR8 or TLR9 百时美施贵宝公司 2022-04-19 CN claimed
CN-111448190-A Substituted indole compounds 百时美施贵宝公司 2020-07-24 CN claimed
US-12600717-B2 Tricyclic compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2026-04-14 US disclosed
US-12441742-B2 Naphthyridine compounds as inhibitors of KRAS INCYTE CORPORATION (US) 2025-10-14 US disclosed
US-20250188073-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS INCYTE CORP (US) 2025-06-12 US disclosed
EP-4548918-A2 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2025-05-07 EP disclosed
EP-4396187-A1 NAPHTHYRIDINE COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2024-07-10 EP disclosed
CN-118265709-A Tetrahydroisoquinoline compounds as KEAP1 binders 希四克斯探索有限公司 2024-06-28 CN disclosed
EP-4370515-A1 TRICYCLIC COMPOUNDS AS INHIBITORS OF KRAS Incyte Corporation (US) 2024-05-22 EP disclosed
CN-111448190-B Substituted indole compounds 百时美施贵宝公司 2023-09-26 CN disclosed
EP-0774462-A1 HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed
WO-1997011069-A1 HETEROCYCLIC COMPOUNDS AS BRADYKININ ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-27 WO disclosed
WO-1997010219-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE IN THE PREVENTION AND/OR THE TREATMENT OF BONE DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-03-20 WO disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
US-5563162-A CAN BE ADMINISTERD FOR THE TREATMENT OF ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASES, SHOCK OR PAIN IN ANIMALS AND HUMANS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-08 US disclosed
EP-0622361-A1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-02 EP disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed
EP-0295109-A1 Process for preparing optically active alcohol Takasago International Corporation (JP) 1988-12-14 EP disclosed