SCHEMBL8535631

SCHEMBL8535631

c1ccc([C@@H]2CN2)cc1

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
SCHEMBL369386 1.00
SCHEMBL1688451 1.00
SCHEMBL15670538 0.97 PRCP (0.50)
SCHEMBL14972873 0.97 PRCP (0.50)
Ammonia Solution, Strong SCHEMBL28071164 0.97 PRCP (0.50)
SCHEMBL1893741 0.97 PRCP (0.50)
SCHEMBL13649836 0.85 KDM1A (0.48)
SCHEMBL15531918 0.84 PRCP (0.41)
SCHEMBL15531917 0.84 PRCP (0.41)
Pyrimidine SCHEMBL9037605 0.84 CHRNB2 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116283797-B Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2024-11-29 CN claimed
CN-116283797-A Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2023-06-23 CN claimed
CN-116283797-B Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2024-11-29 CN disclosed
CN-116283797-B Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2024-11-29 CN disclosed
CN-116283797-A Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2023-06-23 CN disclosed
CN-116283797-A Synthesis method of oxaagoli sodium 浙江车头制药股份有限公司 2023-06-23 CN disclosed
CN-104428331-B Active energy beam polymer resin composition and the laminated body for using the resin combination 东洋油墨SC控股株式会社 2019-02-15 CN disclosed
CN-104428331-A Active energy ray-polymerizable resin composition and laminate obtained using resin composition TOYO INK SC HOLDINGS CO LTD 2015-03-18 CN disclosed
EP-0683156-B1 Acylated aminoalkanimidazoles and -triazoles CIBA GEIGY AG (CH) 1998-04-01 EP disclosed
US-5622982-A ENZYME INHIBITORS; ANTIINFLAMMATORY AGENTS SANDOZ LTD. (CH) 1997-04-22 US disclosed
EP-0683156-A1 Acylated aminoalkanimidazoles and -triazoles SANDOZ LTD. (CH) 1995-11-22 EP disclosed