SCHEMBL506437

SCHEMBL506437

CCCC(CCC)[n+]1cc[nH]c1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F

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
SCHEMBL505628 1.00
SCHEMBL16163416 0.93
SCHEMBL3554363 0.92
Hydrochloric Acid SCHEMBL367182 0.90
Bromide SCHEMBL506424 0.90
SCHEMBL996996 0.85
SCHEMBL5944471 0.84 LMNA (0.30)
SCHEMBL505454 0.83
SCHEMBL4265229 0.83 LMNA (0.32)
SCHEMBL505985 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415913-A1 PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER Donghua University (CN) 2012-02-08 EP claimed
EP-2415913-A1 PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER Donghua University (CN) 2012-02-08 EP disclosed
US-20120027944-A1 PROCESSES FOR PRODUCING CARBON FIBER, THE FILAMENT THEREOF, AND PRE-OXIDIZED FIBER DONGHUA UNIVERSITY (CN) 2012-02-02 US disclosed