SCHEMBL17280375

SCHEMBL17280375

CC(=O)c1ccc(-c2c3c(c(O)c4cc(C)c(C)cc24)COC3=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
KDM4E B2RXH2 2/20 0.51
ALDH1A1 P00352 2/20 0.51
NPSR1 Q6W5P4 2/20 0.51
HPGD P15428 2/20 0.51
MEN1 O00255 1/20 0.51
LMNA P02545 1/20 0.51
HTT P42858 1/20 0.51
KMT2A Q03164 1/20 0.51
HSD17B1 P14061 3/20 0.38
NUAK1 O60285 1/20 0.38
IGF1R P08069 1/20 0.38
MET P08581 1/20 0.38
PIM1 P11309 1/20 0.38
SRC P12931 1/20 0.38
AXL P30530 1/20 0.38
AKT1 P31749 1/20 0.38
KDR P35968 1/20 0.38
NEK2 P51955 1/20 0.38
PLK1 P53350 1/20 0.38

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
SCHEMBL15920747 0.87 ALDH1A1 (0.68) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280359 0.86 KDM4E (0.53) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280373 0.85 ALDH1A1 (0.53) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280363 0.83 KDM4E (0.51) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL10018117 0.80 MEN1 (0.78) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280377 0.79 KDM4E (0.49) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280352 0.79 KDM4E (0.69) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280322 0.78 NUAK1 (0.54) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL17280364 0.74 KDM4E (0.52) MAPTKDM4EALDH1A1NPSR1HPGD
SCHEMBL15920662 0.73 MAPT (0.72) MAPTKDM4EALDH1A1NPSR1HPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9650355-B2 Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2017-05-16 US disclosed
US-20150336938-A1 METHOD FOR PREPARATION OF JUSTICIDIN A DERIVATIVES OF ARYLNAPHTHALENE LIGNAN STRUCTURE KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2015-11-26 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-20150336938-A1 METHOD FOR PREPARATION OF JUSTICIDIN A DERIVATIVES OF ARYLNAPHTHALENE LIGNAN STRUCTURE UGT1A8, NOTUM, MLN MAPT 3028/4885KDM4E 3104/4885ALDH1A1 241/4885

“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.