SCHEMBL7958946

SCHEMBL7958946

O=[N+]([O-])c1ccccc1S(=O)(=O)c1cncc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.57
KIF18A Q8NI77 1/20 0.55
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
VCAM1 P19320 1/20 0.42
ALDH1A1 P00352 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MET P08581 1/20 0.41
POLB P06746 1/20 0.41
F2 P00734 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40

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
SCHEMBL8885322 0.81 KMT2A (0.77) KMT2AMEN1KIF18ACA1CA2
SCHEMBL2041279 0.75 KMT2A (1.00) KMT2AMEN1KIF18ACA1CA2
SCHEMBL11566827 0.75 KMT2A (1.00) KMT2AMEN1CA1CA2MMP1
SCHEMBL30446303 0.75 KMT2A (1.00) KMT2AMEN1CA1CA2MMP1
SCHEMBL2039879 0.75 KMT2A (1.00) KMT2AMEN1CA1CA2MMP1
SCHEMBL7971906 0.74 HTR6 (0.52) KIF18AL3MBTL1ALDH1A1F2LMNA
SCHEMBL8208093 0.72 KMT2A (0.93) KMT2AMEN1KIF18ACA1CA2
SCHEMBL11226703 0.72 KMT2A (0.80) KMT2AMEN1KIF18ACA1CA2
SCHEMBL27749452 0.72 KMT2A (0.80) KMT2AMEN1KIF18ACA1CA2
SCHEMBL7974641 0.72 ALDH1A1 (0.61) KMT2AMEN1CA1CA2ALDH1A1

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-2001017965-A2 CYANOPIPERIDINES AS PESTICIDES SYNGENTA PARTICIPATIONS AG (CH) 2001-03-15 WO disclosed