Nitrogen

Nitrogen

SCHEMBL8136806

N#N.O=[N+]([O-])c1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.58
TSHR P16473 3/20 0.57
LMNA P02545 2/20 0.57
PTPRC P08575 1/20 0.51
KEAP1 Q14145 1/20 0.51
NFE2L2 Q16236 1/20 0.51
FBP1 P09467 1/20 0.50
MPO P05164 1/20 0.50
HSP90AA1 P07900 2/20 0.49
CXCR5 P32302 1/20 0.49
APLNR P35414 1/20 0.49
CCR6 P51684 1/20 0.49
ALDH1A1 P00352 3/20 0.48
ACHE P22303 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ALOX15 P16050 1/20 0.48
TRPV1 Q8NER1 1/20 0.48
MEN1 O00255 1/20 0.48
MAPT P10636 1/20 0.48
KMT2A Q03164 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
SCHEMBL29703748 0.96 TSHR (0.61) KIF11TSHRLMNAPTPRCKEAP1
SCHEMBL439710 0.96 TSHR (0.61) KIF11TSHRLMNAPTPRCKEAP1
Hydrochloric Acid SCHEMBL155430 0.94 KIF11 (0.59) KIF11TSHRLMNAPTPRCKEAP1
SCHEMBL30865102 0.94 KIF11 (0.59) KIF11TSHRLMNAPTPRCKEAP1
Hydrochloric Acid SCHEMBL155429 0.94 KIF11 (0.59) KIF11TSHRLMNAPTPRCKEAP1
SCHEMBL29203888 0.94 KIF11 (0.59) KIF11TSHRLMNAPTPRCKEAP1
Ethylene SCHEMBL28103381 0.93 KIF11 (0.58) KIF11TSHRLMNAPTPRCKEAP1
SCHEMBL28077659 0.91 KIF11 (0.54) KIF11TSHRLMNAPTPRCKEAP1
Methyl Alcohol SCHEMBL7379508 0.91 PTPRC (0.58) KIF11TSHRLMNAPTPRCKEAP1
Bromomethane SCHEMBL28113531 0.91 KIF11 (0.56) KIF11TSHRLMNAPTPRCKEAP1

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
WO-2000000467-A1 METHOD FOR PREPARING AROMATIC PERFLUOROALKYL SULFONE DERIVATIVES RHODIA CHIMIE (FR) 2000-01-06 WO disclosed