SCHEMBL449811

SCHEMBL449811

[c]1ccnc2[c]cccc12

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
SCHEMBL198852 0.84 KDM4E (0.32)
SCHEMBL126263 0.71
SCHEMBL8727 0.70 ALDH1A1 (0.41)
SCHEMBL277687 0.70 NUDT1 (0.32)
SCHEMBL31311 0.70 MAPT (0.39)
SCHEMBL19695 0.70 TSHR (0.42)
SCHEMBL1951437 0.68 CCR1 (0.43)
SCHEMBL18594 0.68 ALDH1A1 (0.44)
SCHEMBL10851 0.68 ALDH1A1 (0.44)
SCHEMBL21831938 0.68 TSHR (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118027987-A Liquid crystal compound and liquid crystal device 华为技术有限公司 2024-05-14 CN claimed
US-8501046-B2 Use of rylene derivatives as photosensitizers in solar cells BASF SE (DE) 2013-08-06 US claimed
US-20120283432-A1 USE OF RYLENE DERIVATIVES AS PHOTOSENSITIZERS IN SOLAR CELLS MAX-PLANCK-GESEL. ZUR FOERDERUNG DER WISSEN. E.V. (DE) 2012-11-08 US claimed
CN-112867724-B Bisphosphonate drug conjugates 熙源安健医药(北京)有限公司 2024-06-04 CN disclosed
CN-118027987-A Liquid crystal compound and liquid crystal device 华为技术有限公司 2024-05-14 CN disclosed
US-20210309679-A1 BISPHOSPHONATE DRUG CONJUGATES GUANGZHOU OTHROTX CO., LTD. (CN) 2021-10-07 US disclosed
CN-113166098-A Triazine compound, material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-07-23 CN disclosed
CN-112867724-A Bisphosphonate drug conjugates 广州噢斯荣医药技术有限公司 2021-05-28 CN disclosed
US-10879473-B2 Organic electronic device NOVALED GMBH (DE) 2020-12-29 US disclosed
CN-107925002-B Organic electronic device 诺瓦尔德股份有限公司 2020-05-01 CN disclosed
US-20180331300-A1 Organic Electronic Device UNIVERSITE DE RENNES (FR) 2018-11-15 US disclosed
EP-2253615-A1 Cyclopropyl amide derivatives AstraZeneca AB (SE) 2010-11-24 EP disclosed
EP-2195293-A2 CYCLOPTOPYL AMIDE DERIVATIVES AstraZeneca AB (SE) 2010-06-16 EP disclosed
WO-2010062245-A1 SPIROCYCLOBUTYL PIPERIDINE DERIVATIVES ASTRAZENECA AB (SE) 2010-06-03 WO disclosed
US-20100130477-A1 Spirocyclobutyl Piperidine Derivatives ASTRAZENECA AB (SE) 2010-05-27 US disclosed
US-20090076020-A1 Cyclopropyl Amide Derivatives 978 ASTRAZENECA AB (SE) 2009-03-19 US disclosed
WO-2009024823-A2 OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS ASTRAZENECA AB (SE) 2009-02-26 WO disclosed
US-6166210-A Perylene imide monocarboxylic acids CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-12-26 US disclosed
EP-1053228-A1 PERYLENE IMIDE MONOCARBOXYLIC ACIDS AS COLORANTS Ciba SC Holding AG (CH) 2000-11-22 EP disclosed
WO-1999031069-A1 PERYLENE IMIDE MONOCARBOXYLIC ACIDS AS COLORANTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1999-06-24 WO disclosed