SCHEMBL1268657

SCHEMBL1268657

CC1=C(Cl)C=CCN1C

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
SCHEMBL29120700 0.74
SCHEMBL9390073 0.63
SCHEMBL2217205 0.60
SCHEMBL7196707 0.60
SCHEMBL7476353 0.58
SCHEMBL1268975 0.56
SCHEMBL9382008 0.56
SCHEMBL2265241 0.55
SCHEMBL29741132 0.55
SCHEMBL16629066 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116987025-B Crystal form of pralidoxime chloride and preparation method thereof 成都瑞尔医药科技有限公司 2024-01-26 CN claimed
CN-116987025-A Crystal form of pralidoxime chloride and preparation method thereof 成都瑞尔医药科技有限公司 2023-11-03 CN claimed
CN-116987025-B Crystal form of pralidoxime chloride and preparation method thereof 成都瑞尔医药科技有限公司 2024-01-26 CN disclosed
CN-116987025-A Crystal form of pralidoxime chloride and preparation method thereof 成都瑞尔医药科技有限公司 2023-11-03 CN disclosed
US-8377972-B2 Use of quaternary pyridinium compounds for vasoprotection and/or hepatoprotection Trigendo Sp. zo.o. (PL) 2013-02-19 US disclosed
US-20110118316-A1 Use of Quaternary Pyridinium Compounds for Vasoprotection and/or Hepatoprotection TRIGENDO SP. Z O.O. (PL) 2011-05-19 US disclosed
US-7893095-B2 Treatment or prevention of diseases or conditions associated with vascular endothelium dysfunction or liver injury; 1,4-dimethylpyridinium Chloride; diabetes, metabolic syndrome, atherosclerosis TRIGENDO SP. Z O.O. (PL) 2011-02-22 US disclosed
US-20080221172-A1 Use of Quaternary Pyridinium Compounds for Vasoprotection and/or Hepatoprotection TRIGENDO SP. Z O.O. 2008-09-11 US disclosed