SCHEMBL5459219

SCHEMBL5459219

COc1ccc2cc(CNC(N)=S)c(=O)[nH]c2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.58
HSD17B10 Q99714 11/20 0.58
MAPT P10636 5/20 0.58
ALOX15 P16050 2/20 0.58
TP53 P04637 1/20 0.58
ALDH1A1 P00352 9/20 0.57
TSHR P16473 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
CYP1A2 P05177 2/20 0.55
HPGD P15428 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
IDH1 O75874 1/20 0.53
NPC1 O15118 3/20 0.52
GAA P10253 3/20 0.52
APAF1 O14727 1/20 0.52
MAPK1 P28482 1/20 0.52
CASP1 P29466 1/20 0.52
CASP7 P55210 1/20 0.52
RAB9A P51151 2/20 0.52
KMT2A Q03164 2/20 0.52

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
SCHEMBL5445669 0.90 KDM4E (0.65) KDM4EHSD17B10MAPTALOX15ALDH1A1
SCHEMBL7073150 0.77 KDM4E (0.63) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL4659631 0.76 KDM4E (0.61) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL7075514 0.75 HSD17B10 (0.68) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL4078718 0.74 MAPT (0.69) KDM4EHSD17B10MAPTALOX15ALDH1A1
SCHEMBL3846232 0.74 KDM4E (0.56) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL7073003 0.73 HSD17B10 (0.66) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL24277189 0.72 KMT2A (0.58) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL21637918 0.72 ALDH1A1 (0.66) KDM4EHSD17B10MAPTALOX15TP53
SCHEMBL2226834 0.72 APLNR (0.63) TP53ALDH1A1TSHRSMN1; SMN2HPGD

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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof ABCG2, ATP5ME, ATP5MG KDM4E 2403/4885HSD17B10 1580/4885MAPT 4297/4885

“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.