SCHEMBL9175232

SCHEMBL9175232

[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4].[Ti+4]

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
SCHEMBL2036947 1.00 — —
SCHEMBL1470153 1.00 — —
SCHEMBL11307919 1.00 — —
SCHEMBL5867287 1.00 — —
SCHEMBL12490819 1.00 — —
SCHEMBL11154902 1.00 — —
SCHEMBL8866284 1.00 — —
SCHEMBL5193021 1.00 — —
SCHEMBL5867290 1.00 — —
SCHEMBL8724001 1.00 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106824123-A A kind of air catalytic composite of modified carbon nano-tube 山东佳星环保科技有限公司 2017-06-13 — — CN claimed
CN-106824123-A A kind of air catalytic composite of modified carbon nano-tube 山东佳星环保科技有限公司 2017-06-13 — — CN disclosed
CN-106824123-A A kind of air catalytic composite of modified carbon nano-tube 山东佳星环保科技有限公司 2017-06-13 — — CN disclosed
EP-0439111-B1 Opalescent coatings containing foamed metal oxides BASF CORP (US) 1995-04-05 — — EP disclosed
US-5049442-A Natural hues BASF CORPORATION (US) 1991-09-17 — — US disclosed
EP-0439111-A1 Opalescent coatings containing foamed metal oxides BASF Corporation (US) 1991-07-31 — — EP disclosed
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