SCHEMBL11244170

SCHEMBL11244170

N#[N+]c1ccccc1.Nc1c[nH]nn1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Hydrochloric Acid SCHEMBL2833399 0.73
SCHEMBL11667114 0.73
SCHEMBL31544710 0.73
SCHEMBL2043163 0.73
SCHEMBL29039678 0.71 TSHR (0.54)
SCHEMBL37140 0.71
Aniline SCHEMBL10968924 0.69 TSHR (0.58)
Ammonia Solution, Strong SCHEMBL23611461 0.68
Iodide SCHEMBL18428509 0.68
Water SCHEMBL11963057 0.68

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-4341700-A Monoazo compounds having a substituted 1,2,3-triazolyl-5 diazo component radical and an unsubstituted or substituted 1,4-phenylene coupling component radical SANDOZ LTD. (CH) 1982-07-27 US disclosed