SCHEMBL5429892

SCHEMBL5429892

CNC(=O)c1cccc(-c2c(Cl)ccc(N)c2Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.45
HDAC6 Q9UBN7 1/20 0.45
MAP4K4 O95819 1/20 0.44
NR1H2 P55055 1/20 0.43
NR1H3 Q13133 1/20 0.43
CDK8 P49336 1/20 0.41
NR4A2 P43354 1/20 0.41
PDK2 Q15119 1/20 0.41
CRBN Q96SW2 1/20 0.41
HDAC2 Q92769 1/20 0.40
MEN1 O00255 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
DOT1L Q8TEK3 1/20 0.39
SLC7A5 Q01650 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
SCN9A Q15858 1/20 0.39
SCN2A Q99250 1/20 0.39

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
SCHEMBL5424173 0.89 HDAC8 (0.50) HDAC8HDAC6MAP4K4NR1H2NR1H3
SCHEMBL5427874 0.85 NR1H2 (0.48) HDAC8HDAC6MAP4K4NR1H2NR1H3
SCHEMBL5423712 0.84 HDAC8 (0.54) HDAC8HDAC6MAP4K4NR1H2NR1H3
SCHEMBL5423820 0.84 HDAC8 (0.49) HDAC8HDAC6MAP4K4NR1H2NR1H3
SCHEMBL5427907 0.81 RAF1 (0.48) HDAC8HDAC6NR1H2NR1H3CDK8
SCHEMBL5428135 0.80 MAPT (0.44) HDAC8HDAC6NR1H2NR1H3MEN1
SCHEMBL5431921 0.79 NR1H2 (0.52) HDAC8HDAC6NR1H2NR1H3CDK8
SCHEMBL13702375 0.75 HDAC8 (0.68) HDAC8HDAC6MAP4K4CDK8NR4A2
SCHEMBL5433592 0.74 HDAC8 (0.53) HDAC8HDAC6MAP4K4NR1H2NR1H3
SCHEMBL879253 0.73 ALDH1A1 (0.53) HDAC8HDAC6HDAC2MEN1MAPT

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-20070135497-A1 Biphenyl derivative or its salt, and pesticide containing it as an active ingredient ISHIHARA SANGYO KAISHA LTD. (JP) 2007-06-14 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070135497-A1 Biphenyl derivative or its salt, and pesticide containing it as an active ingredient DDT, HCN1, HCN2 HDAC8 967/4885HDAC6 1100/4885MAP4K4 4409/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.