SCHEMBL27566441

SCHEMBL27566441

O=[N+]([O-])C1=C(c2ccccc2)C2=NC1=CC1=NC(=CC3=NC(=CC4=NC(=C2c2ccccc2)C(c2ccccc2)=C4c2ccccc2)C=C3)C=C1

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
SCHEMBL29273388 0.91 — —
SCHEMBL272541 0.88 — —
SCHEMBL28689098 0.86 ALDH1A1 (0.33) —
SCHEMBL28604388 0.86 — —
SCHEMBL27513464 0.84 — —
SCHEMBL27206851 0.82 — —
SCHEMBL27920656 0.81 — —
SCHEMBL27679602 0.81 — —
SCHEMBL7060717 0.81 — —
SCHEMBL6494403 0.81 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113461696-B Porphyrin phthalocyanine covalent dual-functionalized graphene nonlinear nano hybrid material and preparation method thereof 同济大学 2022-11-01 — — CN claimed
CN-113461696-A Porphyrin phthalocyanine covalent dual-functionalized graphene nonlinear nano hybrid material and preparation method thereof 同济大学 2021-10-01 — — CN claimed
CN-103487416-B A kind of based on the fluorescent optical sensor of asymmetrical porphyrin fluorescence than detection zinc ion ZHONGBEI UNIV (CN) 2016-01-20 — — CN claimed
CN-103487416-A Fluorescent sensor for detecting zinc ions based on asymmetrical porphyrin fluorescence ratio UNIV NORTH CHINA 2014-01-01 — — CN claimed
CN-113461696-B Porphyrin phthalocyanine covalent dual-functionalized graphene nonlinear nano hybrid material and preparation method thereof 同济大学 2022-11-01 — — CN disclosed
CN-113200539-B Porphyrin edge covalent fused graphene nonlinear nano hybrid material and preparation method thereof 同济大学 2022-09-06 — — CN disclosed
CN-114989207-A Supported metalloporphyrin complex, preparation method and application 中国科学院长春应用化学研究所 2022-09-02 — — CN disclosed
CN-113461696-A Porphyrin phthalocyanine covalent dual-functionalized graphene nonlinear nano hybrid material and preparation method thereof 同济大学 2021-10-01 — — CN disclosed
CN-113200539-A Porphyrin edge covalent fused graphene nonlinear nano hybrid material and preparation thereof 同济大学 2021-08-03 — — CN disclosed
CN-103487416-B A kind of based on the fluorescent optical sensor of asymmetrical porphyrin fluorescence than detection zinc ion ZHONGBEI UNIV (CN) 2016-01-20 — — CN disclosed
CN-103487416-A Fluorescent sensor for detecting zinc ions based on asymmetrical porphyrin fluorescence ratio UNIV NORTH CHINA 2014-01-01 — — CN disclosed
CN-1279907-C Novel metalloporphyrins and their uses as radiosensitizers for radiation therapy BROOKHAVEN SCIENCE ASS LLC (US) 2006-10-18 — — CN disclosed
CN-1234709-C Biporphin metal coordination compound with bridge linking face-face structure and its use SHANDONG SCIENCE & ENGINEERING (CN) 2006-01-04 — — CN disclosed
CN-1620289-A Novel metalloporphyrin compounds and their use as radiosensitizers in radiotherapy BROOKHAVEN SCIENCE ASS LLC (US) 2005-05-25 — — CN disclosed
CN-1472211-A Biporphin metal coordination compound with bridge linking face-face structure and its use 山东理工大学 2004-02-04 — — CN disclosed
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