SCHEMBL28562018

SCHEMBL28562018

[N-]=[N+]=NNOc1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.35
TSHR P16473 1/20 0.35
CA4 P22748 1/20 0.32
SRC P12931 1/20 0.31
KCNA3 P22001 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
SCHEMBL7520479 0.70 CA1 (0.39) LTA4HTSHRCA4SRCKCNA3
SCHEMBL710048 0.65 TDP1 (0.43) TSHR
SCHEMBL9841149 0.65 LTA4H (0.39) LTA4HTSHRCA4SRCKCNA3
SCHEMBL1790430 0.65 LTA4H (0.50) LTA4HTSHRCA4SRCKCNA3
SCHEMBL21611918 0.64 LTA4H (0.50) LTA4HTSHR
Hydrochloric Acid SCHEMBL711911 0.64 TDP1 (0.41) TSHR
SCHEMBL21328562 0.63 LTA4H (0.47) LTA4HTSHRCA4SRCKCNA3
Hydrochloric Acid SCHEMBL29091986 0.63 LTA4H (0.47) LTA4HTSHRCA4SRCKCNA3
SCHEMBL2121426 0.63 LTA4H (0.47) LTA4HTSHRCA4SRCKCNA3
SCHEMBL2362723 0.61

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112840210-A System, sensor and method for determining analyte concentration 澳科环球有限公司 2021-05-25 CN claimed
CN-112840210-A System, sensor and method for determining analyte concentration 澳科环球有限公司 2021-05-25 CN disclosed