SCHEMBL19099790

SCHEMBL19099790

CC(N)C(N)Br

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
Bromide SCHEMBL28990250 0.95
Bromide SCHEMBL28990252 0.95
Bromide SCHEMBL28990248 0.95
SCHEMBL8517900 0.80
SCHEMBL11348705 0.80
SCHEMBL200030 0.78
Bromide SCHEMBL27657296 0.76
Hydrochloric Acid SCHEMBL217319 0.74
Bromide SCHEMBL669145 0.74
SCHEMBL8133423 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190708-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2017-07-06 US disclosed