SCHEMBL9827872

SCHEMBL9827872

[N-]=[N+]=C1CC=CC=C1N

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
SCHEMBL53707 0.74
SCHEMBL7847805 0.73
SCHEMBL4159019 0.73
SCHEMBL11405157 0.73
SCHEMBL9640051 0.73
SCHEMBL11356101 0.71
SCHEMBL11571800 0.70
SCHEMBL5556412 0.70
SCHEMBL4940644 0.67
SCHEMBL1526040 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3148664-A None JP disclosed
JP-H03148664-A DEVELOPING SOLUTION FOR DAMPING-WATERLESS PHOTOSENSITIVE PLANOGRAPHIC PRINTING PLATE KONICA CORP 1991-06-25 JP disclosed
EP-0415238-A2 Method of producing support for planographic printing-plate FUJI PHOTO FILM CO., LTD. (JP) 1991-03-06 EP disclosed
US-3992333-A NITROGEN AND SULFUR CONTAINING COPOLYMER IS SELF-CROSSLINKING BINDER ROHM AND HAAS COMPANY (US) 1976-11-16 US disclosed