SCHEMBL4268178

SCHEMBL4268178

O=C1C=CCC2=CNCC=C12

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
SCHEMBL7436380 0.73
SCHEMBL2777592 0.69
SCHEMBL8699648 0.63
SCHEMBL7836944 0.60
SCHEMBL4254738 0.59
SCHEMBL2007098 0.59 GSK3A (0.39)
SCHEMBL447698 0.56
SCHEMBL3462882 0.55 CRBN (0.39)
SCHEMBL918294 0.54 ADRA2A (0.31)
SCHEMBL20077863 0.54

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023205680-A1 PI3Kα INHIBITORS SYNNOVATION THERAPEUTICS, INC. (US) 2023-10-26 WO claimed
WO-2023165591-A1 COMPOUNDS AND THEIR USES AS LPAR5 ANTAGONISTS IMMUTHER PHARMATECH (SHANGHAI) CO., LTD. (CN) 2023-09-07 WO claimed
EP-1989204-B1 PYRAZOLOQUINOLONES ARE POTENT PARP INHIBITORS ABBVIE INC (US) 2014-05-21 EP claimed
EP-1252161-A1 PYRROLO-ISOQUINOLINE AND TETRAHYDROPYRROLO-ISOQUINOLINE DERIVATIVES AND THEIR USE AS MEDIATORS OF THE 5-HT7 RECEPTOR Wyeth (US) 2002-10-30 EP claimed
WO-2001057039-A1 PYRROLO-ISOQUINOLINE AND TETRAHYDROPYRROLO-ISOQUINOLINE DERIVATIVES AND THEIR USE AS MEDIATORS OF THE 5-HT7 RECEPTOR WYETH (US) 2001-08-09 WO claimed
CN-1218472-A Pharmaceutically useful compounds ASTRA PHARMA PROD (GB) 1999-06-02 CN claimed
EP-4531849-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2025-04-09 EP disclosed
CN-119604287-A Heterocyclic PAD4 inhibitors 细胞基因公司 2025-03-11 CN disclosed
CN-117377671-A Diacylglycerol kinase modulating compounds 吉利德科学公司 2024-01-09 CN disclosed
WO-2023230609-A1 HETEROCYCLIC PAD4 INHIBITORS CELGENE CORPORATION (US) 2023-11-30 WO disclosed
WO-2023205680-A1 PI3Kα INHIBITORS SYNNOVATION THERAPEUTICS, INC. (US) 2023-10-26 WO disclosed
CN-115677701-A Benzo heterocyclic compound and preparation method and application thereof 昆药集团股份有限公司 2023-02-03 CN disclosed
CN-115087486-A Substituted bicyclic and tricyclic ureas and amides, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2022-09-20 CN disclosed
EP-0293777-B1 CARDIOTONIC TRICYCLIC OXAZOLONES MERRELL DOW PHARMACEUTICALS INC. (US) 1992-12-23 EP disclosed
EP-0292711-B1 CARDIOTONIC TRICYCLIC IMIDAZOLONES MERRELL DOW PHARMACEUTICALS INC. (US) 1992-03-11 EP disclosed
US-4803210-A Cardiotonic tricyclic oxazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1989-02-07 US disclosed
EP-0293777-A1 Cardiotonic tricyclic oxazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1988-12-07 EP disclosed
EP-0292711-A1 Cardiotonic tricyclic imidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1988-11-30 EP disclosed
US-4743607-A ENHANCING MYOCARDIAL CONTRACTILE FORCE MERRELL DOW PHARMACEUTICALS INC. (US) 1988-05-10 US disclosed
EP-0022078-B1 PYRAZOLO-QUINOLINES, PROCESSES FOR THEIR PRODUCTION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM CIBA-GEIGY AG (CH) 1984-07-25 EP disclosed