SCHEMBL5428883

SCHEMBL5428883

CNC(=O)c1cccc(-c2c(C)cc(OC)cc2C)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
ALDH1A1 P00352 2/20 0.51
NR1H2 P55055 1/20 0.49
NR1H3 Q13133 1/20 0.49
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
PLK1 P53350 2/20 0.49
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 1/20 0.47
HPGD P15428 1/20 0.47
LRRK2 Q5S007 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
FFAR1 O14842 1/20 0.46
POLB P06746 2/20 0.45
TP53 P04637 1/20 0.45

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
SCHEMBL5433592 0.85 HDAC8 (0.53) NR1H2NR1H3HDAC8HDAC6SMN1; SMN2
SCHEMBL5428822 0.84 RAB9A (0.51) MEN1KMT2ASMN1; SMN2KDM4ENPC1
SCHEMBL5431921 0.84 NR1H2 (0.52) ALDH1A1NR1H2NR1H3HDAC8HDAC6
SCHEMBL5433882 0.82 FFAR1 (0.47) MEN1KMT2AALDH1A1HSD17B2SMN1; SMN2
SCHEMBL3850447 0.78 NPC1 (0.70) MEN1KMT2AALDH1A1PLK1HDAC8
SCHEMBL30416225 0.78 NPC1 (0.70) MEN1KMT2AALDH1A1PLK1HDAC8
SCHEMBL13702375 0.78 HDAC8 (0.68) HDAC8HDAC6CYP3A4
SCHEMBL5423712 0.77 HDAC8 (0.54) ALDH1A1NR1H2NR1H3HDAC8HDAC6
Hydrochloric Acid SCHEMBL30102161 0.77 NPC1 (0.68) MEN1KMT2AALDH1A1PLK1HDAC8
SCHEMBL5427874 0.76 NR1H2 (0.48) ALDH1A1NR1H2NR1H3HDAC8HDAC6

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 MEN1 3354/4885KMT2A 135/4885ALDH1A1 3141/4885

“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.