SCHEMBL505454

SCHEMBL505454

CCCC(C)[n+]1cc[nH]c1.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
SCHEMBL505985 1.00
SCHEMBL597792 0.92 TSHR (0.31)
Bromide SCHEMBL367567 0.90 TSHR (0.30)
Iodide SCHEMBL1458237 0.90 TSHR (0.30)
Hydrochloric Acid SCHEMBL366958 0.90 TSHR (0.30)
SCHEMBL16163417 0.89
SCHEMBL506437 0.83
SCHEMBL505628 0.83
SCHEMBL6435531 0.82 LMNA (0.30)
Thiocyanic Acid SCHEMBL14483394 0.82

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 8 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
US-12478064-B2 Microcapsules and processes for their preparation YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2025-11-25 US disclosed
EP-3713666-B1 PROCESSES FOR THE PREPARATION OF MICROCAPSULES YISSUM RES DEV CO OF HEBREW UNIV JERUSALEM LTD (IL) 2024-02-28 EP disclosed
US-20230172195-A1 MICROCAPSULES AND PROCESSES FOR THEIR PREPARATION Yissrm Research Developmet Company of The Hebrew University of Jerusalem Ltd. (IL) 2023-06-08 US disclosed
EP-3713666-A1 MICROCAPSULES AND PROCESSES FOR THEIR PREPARATION Yissum Research Development Company of the Hebrew University of Jerusalem Ltd. (IL) 2020-09-30 EP disclosed
WO-2019102468-A1 MICROCAPSULES AND PROCESSES FOR THEIR PREPARATION YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) 2019-05-31 WO disclosed
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