SCHEMBL4710658

SCHEMBL4710658

O=CC1=CC=COO1

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
SCHEMBL20769474 0.65
SCHEMBL2357920 0.65
SCHEMBL28246367 0.61
SCHEMBL28281416 0.60
SCHEMBL692809 0.60
SCHEMBL2016425 0.60
SCHEMBL1934967 0.59
SCHEMBL4462207 0.57
SCHEMBL4966817 0.57 CA1 (0.30)
SCHEMBL1404391 0.56

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103435505-A Method for synthesizing -salmeterol NANJING UNIVERSITY OF TECHNOLOGY 2013-12-11 CN claimed
CN-101180298-A Novel antibiotic derivatives ACTELION PHARMACEUTICALS LTD (CH) 2008-05-14 CN claimed
WO-2023125681-A1 HETEROCYCLIC COMPOUNDS BEIGENE, LTD. (KY) 2023-07-06 WO disclosed
EP-4136084-A1 BCL-2 INHIBITOR BeiGene, Ltd. (KY) 2023-02-22 EP disclosed
CN-111518166-B Peptidomimetics compound or pharmaceutically acceptable salt thereof, and preparation method and application thereof 中国药科大学 2023-01-31 CN disclosed
WO-2021208963-A1 BCL-2 INHIBITOR BEIGENE, LTD. (KY) 2021-10-21 WO disclosed
CN-110403939-A For treating the tricyclic nitrogenous compound of N. gonorrhoeae infections GLAXOSMITHKLINE INTELECTUAL PROPERTY DEV LTD 2019-11-05 CN disclosed
CN-106659717-B Tricyclic nitrogen-containing compounds for the treatment of neisseria gonorrhoeae infections 葛兰素史密斯克莱知识产权发展有限公司 2019-09-06 CN disclosed
CN-110177787-A Integrin antagonists 圣路易斯大学 2019-08-27 CN disclosed
CN-106659717-A Tricyclic nitrogen-containing compounds for the treatment of neisseria gonorrhoeae infections 葛兰素史密斯克莱知识产权发展有限公司 2017-05-10 CN disclosed
EP-3074377-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2016-10-05 EP disclosed
WO-2004035569-A2 NOVEL COMPOUNDS WITH ANTIBACTERIAL ACTIVITY Morphochem Aktiengesellschaft für kombinatorische Chemie (DE) 2004-04-29 WO disclosed
CN-1139584-C Heterocyclic compounds, method for preparing and medicine compositions containing same ɪά��ʵ���� 2004-02-25 CN disclosed
WO-2003106452-A2 ANTAGONISTS OF MELANIN CONCENTRATING HORMONE RECEPTOR MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-12-24 WO disclosed
CN-1396920-A 1, 3-disubstituted pyrrolidines as alpha-2-adrenoreceptor antagonists NOVARTIS AG (CH) 2003-02-12 CN disclosed
CN-1373745-A 3-amino-2-benzyl-1-phenyl-propane derivs. GREULENTHAL GMBH (DE) 2002-10-09 CN disclosed
CN-1332711-A Vitamin D analogues GALDERMA RES & DEV (FR) 2002-01-23 CN disclosed
CN-1067071-C Carboline derivatives ICOS CORP (US) 2001-06-13 CN disclosed
CN-1260789-A Heterocyclic compounds, method for preparing and medicine compositions containing same ADIR CO (FR) 2000-07-19 CN disclosed
CN-1218471-A Carboline derivatives ICOS CORP (US) 1999-06-02 CN disclosed