SCHEMBL9818646

SCHEMBL9818646

Cc1cc(C(F)(F)C(F)(F)F)nc(NC(=O)NS(=O)(=O)c2ccccc2[N+](=O)[O-])n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.46
MEN1 O00255 1/20 0.43
CYP2C9 P11712 1/20 0.43
KMT2A Q03164 1/20 0.43
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
PKM P14618 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MAPT P10636 1/20 0.41
ALKBH2 Q6NS38 1/20 0.41
ALKBH5 Q6P6C2 1/20 0.41
ALKBH3 Q96Q83 1/20 0.41
FTO Q9C0B1 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
MMP13 P45452 1/20 0.41

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
SCHEMBL11112387 0.88 POLB (0.54) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL10459798 0.85 POLB (0.48) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL10647898 0.83 POLB (0.43) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL10755571 0.81 POLB (0.44) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL10909263 0.81 GAA (0.52) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL10454401 0.80 POLB (0.43) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL8879243 0.80 GAA (0.53) KMT2ATHRBL3MBTL1PKMMAPT
SCHEMBL8874996 0.79 GAA (0.53) KMT2ATHRBL3MBTL1PKMMAPT
SCHEMBL10566316 0.79 MEN1 (0.45) POLBMEN1CYP2C9KMT2ATHRB
SCHEMBL3631679 0.79 ALKBH2 (0.51) POLBMEN1KMT2ATHRBL3MBTL1

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
US-4999046-A Herbicides and plant growth regulators, agricultural use CIBA-GEIGY CORPORATION (US) 1991-03-12 US disclosed