SCHEMBL10384367

SCHEMBL10384367

N=C(Nc1cccc(C(F)(F)F)c1)N[N+](=O)[O-]

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
GAA P10253 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
XBP1 P17861 1/20 0.52
LMNA P02545 1/20 0.52
TRPV1 Q8NER1 1/20 0.52
ALDH1A1 P00352 3/20 0.51
KIF11 P52732 1/20 0.51
GRIK1 P39086 1/20 0.51
TDP1 Q9NUW8 1/20 0.50
TP53 P04637 1/20 0.50
KDR P35968 1/20 0.48
IDO1 P14902 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL10384387 0.88 MAPT (0.42) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL6676241 0.86 TRPV1 (0.40) MAPTMEN1KMT2AHTTRAB9A
Hydrochloric Acid SCHEMBL6684920 0.85 TRPV1 (0.39) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL2288364 0.83 MAPT (0.64) MAPTMEN1KMT2AHTTRAB9A
Nitric Acid SCHEMBL4479271 0.80 ALDH1A1 (0.55) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL10383819 0.80 MAPT (0.50) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL10384379 0.78 MEN1 (0.50) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL10383502 0.78 TRPV1 (0.46) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL10384376 0.78 MEN1 (0.53) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL23720127 0.77 L3MBTL1 (0.58) MAPTMEN1KMT2AHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4944788-A Substituted nitro and cyanoguanidines and their use for increasing crop yields AMERICAN CYANAMID COMPANY (US) 1990-07-31 US claimed
EP-0113070-A1 The use of substituted nitro and cyanoguanidines for increasing crop yield AMERICAN CYANAMID COMPANY (US) 1984-07-11 EP claimed
US-4944788-A Substituted nitro and cyanoguanidines and their use for increasing crop yields AMERICAN CYANAMID COMPANY (US) 1990-07-31 US disclosed
US-4804780-A PLANT GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1989-02-14 US disclosed
EP-0113070-B1 THE USE OF SUBSTITUTED NITRO AND CYANOGUANIDINES FOR INCREASING CROP YIELD AMERICAN CYANAMID COMPANY (US) 1988-01-13 EP disclosed
EP-0189579-A1 Substituted nitro and cyanoguanidines and their use for increasing crop yield AMERICAN CYANAMID COMPANY (US) 1986-08-06 EP disclosed
US-4594092-A Cytokinin-like response AMERICAN CYANAMID COMPANY (US) 1986-06-10 US disclosed
EP-0113070-A1 The use of substituted nitro and cyanoguanidines for increasing crop yield AMERICAN CYANAMID COMPANY (US) 1984-07-11 EP disclosed