SCHEMBL10608686

SCHEMBL10608686

O=C(CCl)[N+]1([O-])CCCCC1

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
SCHEMBL7132808 0.76 TERT (0.38)
SCHEMBL4062497 0.69
SCHEMBL1238338 0.69
SCHEMBL4059820 0.69
SCHEMBL18170327 0.68
SCHEMBL14915497 0.67
SCHEMBL641601 0.67 TSHR (0.32)
SCHEMBL431934 0.66
SCHEMBL14914735 0.64
SCHEMBL6580066 0.62 LMNA (0.34)

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-0235197-A1 POLY(1-OXY-3-LACTAM VINYLENES). UNIV SOUTHERN MISSISSIPPI (US) 1987-09-09 EP claimed
WO-1987001709-A1 POLY(1-OXY-3-LACTAM VINYLENES) THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1987-03-26 WO claimed
US-4644050-A Poly(1-oxy-3-lactam vinylene) UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1987-02-17 US claimed
EP-0235197-B1 POLY(1-OXY-3-LACTAM VINYLENES) The University of Southern Mississippi (US) 1989-12-13 EP disclosed
EP-0235197-A1 POLY(1-OXY-3-LACTAM VINYLENES). UNIV SOUTHERN MISSISSIPPI (US) 1987-09-09 EP disclosed
WO-1987001709-A1 POLY(1-OXY-3-LACTAM VINYLENES) THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1987-03-26 WO disclosed
US-4644050-A Poly(1-oxy-3-lactam vinylene) UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1987-02-17 US disclosed
EP-0068041-B1 FLOWABLE HERBICIDE AND PESTICIDE COMPOSITIONS AND THEIR USE J.T. Baker Chemical Co. (US) 1985-08-21 EP disclosed