SCHEMBL29079008

SCHEMBL29079008

O=C(Cl)c1ccc(C(F)(F)F)cc1[N+](=O)[O-].[PbH2]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPD P32754 3/20 0.58
FLT1 P17948 1/20 0.56
FLT4 P35916 1/20 0.56
KDR P35968 1/20 0.56
ALDH1A1 P00352 4/20 0.51
TDP1 Q9NUW8 2/20 0.51
CYP3A4 P08684 2/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
HIF1A Q16665 1/20 0.51
TXNRD1 Q16881 1/20 0.51
TXNRD3 Q86VQ6 1/20 0.51
TXNRD2 Q9NNW7 1/20 0.51
KCNMA1 Q12791 1/20 0.49
MAPT P10636 4/20 0.47
AKR1B1 P15121 2/20 0.47
AKR1C4 P17516 2/20 0.47
AKR1C3 P42330 2/20 0.47
AKR1C2 P52895 2/20 0.47

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
SCHEMBL2323726 0.98 HPD (0.59) HPDFLT1FLT4KDRALDH1A1
SCHEMBL8491405 0.86 HPD (0.47) HPDFLT1FLT4KDRALDH1A1
SCHEMBL442397 0.84 HPD (0.60) HPDFLT1FLT4KDRALDH1A1
SCHEMBL5452045 0.84 HPD (0.60) HPDFLT1FLT4KDRALDH1A1
Ammonia Solution, Strong SCHEMBL28953061 0.83 HPD (0.59) HPDFLT1FLT4KDRALDH1A1
SCHEMBL8492671 0.83 NPC1 (0.51) HPDFLT1FLT4KDRALDH1A1
SCHEMBL165527 0.83 HPD (0.59) HPDFLT1FLT4KDRALDH1A1
Hydrochloric Acid SCHEMBL11776053 0.83 HPD (0.59) HPDFLT1FLT4KDRALDH1A1
SCHEMBL4658862 0.83 HPD (0.62) HPDFLT1FLT4KDRALDH1A1
SCHEMBL4167623 0.82 FLT1 (0.60) HPDFLT1FLT4KDRALDH1A1

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
CN-116640063-A Preparation method of nitenpyram 安徽贝克制药股份有限公司 2023-08-25 CN disclosed