SCHEMBL9268786

SCHEMBL9268786

NN=CN=Nc1ccnnn1

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
SCHEMBL29549338 0.77
SCHEMBL9260367 0.73
SCHEMBL7034297 0.68
SCHEMBL9416253 0.68
SCHEMBL8511120 0.65
SCHEMBL1576319 0.65
SCHEMBL7753486 0.65
SCHEMBL28565567 0.65
SCHEMBL26914688 0.60
SCHEMBL5691026 0.59 MAOA (0.35)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0021351-B1 FORMAZAN REACTIVE BLUE DYES, A PROCESS FOR THEIR PREPARATION AND A PROCESS FOR DYEING CELLULOSE FIBERS THEREWITH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-04-20 EP claimed
EP-0021351-A1 Formazan reactive blue dyes, a process for their preparation and a process for dyeing cellulose fibers therewith SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-01-07 EP claimed
JP-7304988-A None JP disclosed
JP-H07304988-A BLUE REACTIVE DYE MIXTURE HAVING IMPROVED METAMERISM BAYER AG 1995-11-21 JP disclosed
US-4720542-A Formazan blue reactive dye SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-01-19 US disclosed
EP-0021351-B1 FORMAZAN REACTIVE BLUE DYES, A PROCESS FOR THEIR PREPARATION AND A PROCESS FOR DYEING CELLULOSE FIBERS THEREWITH SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-04-20 EP disclosed
EP-0021351-A1 Formazan reactive blue dyes, a process for their preparation and a process for dyeing cellulose fibers therewith SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-01-07 EP disclosed