SCHEMBL17237759

SCHEMBL17237759

CC(=O)Oc1cccc2oc(C)cc(=O)c12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.52
HSD17B10 Q99714 7/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
MAPT P10636 7/20 0.46
TP53 P04637 3/20 0.46
GAA P10253 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 2/20 0.46
RECQL P46063 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 1/20 0.46
ALOX15 P16050 1/20 0.46
CYP3A4 P08684 4/20 0.46
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
CASP1 P29466 2/20 0.46
CASP7 P55210 2/20 0.46
ALOX12 P18054 1/20 0.46

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
SCHEMBL9976085 0.81 ALDH1A1 (0.65) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL28632938 0.80 CYP3A4 (0.71) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL9137058 0.76 KDM4E (0.56) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL8493104 0.75 KDM4E (0.52) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL8494882 0.75 NQO1 (0.52) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL31670262 0.74 MAPT (0.64) KDM4EHSD17B10MAPTTP53GAA
SCHEMBL620145 0.74 MAPT (0.64) KDM4EHSD17B10MAPTTP53GAA
SCHEMBL5303760 0.74 KDM4E (0.50) KDM4EHSD17B10NPC1RAB9AMAPT
SCHEMBL20886870 0.73 MAPT (0.53) KDM4EHSD17B10MAPTTP53GAA
SCHEMBL30087046 0.73 MAPT (0.53) KDM4EHSD17B10MAPTTP53GAA

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-20160143878-A1 ANTIBACTERIAL AGENT JUNTENDO EDUCATIONAL FOUNDATION (JP) 2016-05-26 US disclosed
US-20150322033-A1 ANTIBACTERIAL AGENT JUNTENDO EDUCATIONAL FOUNDATION (JP) 2015-11-12 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 (2 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-20160143878-A1 ANTIBACTERIAL AGENT MRPL21, Q6ZSR9, NQO2 KDM4E 3210/4885HSD17B10 725/4885NPC1 2966/4885
US-20150322033-A1 ANTIBACTERIAL AGENT Q6ZSR9, MRPL21, NQO2 KDM4E 3156/4885HSD17B10 805/4885NPC1 3145/4885

“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.