SCHEMBL5453758

SCHEMBL5453758

COc1ccc(NC(=S)N(CCN(C)C)Cc2cc3cc(OC)c(OC)cc3[nH]c2=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.69
ALDH1A1 P00352 12/20 0.69
HSD17B10 Q99714 2/20 0.62
TSHR P16473 1/20 0.62
MAPT P10636 5/20 0.61
HPGD P15428 5/20 0.61
KMT2A Q03164 4/20 0.61
LMNA P02545 3/20 0.61
MEN1 O00255 2/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPK1 P28482 1/20 0.58
GAA P10253 1/20 0.58
GUSB P08236 2/20 0.57
HTT P42858 1/20 0.56
POLB P06746 1/20 0.55

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
SCHEMBL4069455 0.83 ALDH1A1 (0.64) KDM4EALDH1A1HSD17B10TSHRMAPT
SCHEMBL4072881 0.82 MAPT (0.72) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL4250505 0.81 ALDH1A1 (0.78) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL4079416 0.80 KDM4E (0.84) KDM4EALDH1A1HSD17B10MAPTHPGD
SCHEMBL4073889 0.76 KDM4E (0.66) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL18270621 0.73 GUSB (1.00) KDM4EALDH1A1HSD17B10MAPTKMT2A
SCHEMBL14300067 0.72 GUSB (1.00) KDM4EALDH1A1MAPTHPGDKMT2A
SCHEMBL4073652 0.70 KDM4E (0.83) KDM4EALDH1A1HSD17B10HPGDKMT2A
SCHEMBL13496395 0.68 ALDH1A1 (0.73) KDM4EALDH1A1HSD17B10TSHRMAPT
SCHEMBL13496398 0.68 KDM4E (0.77) KDM4EALDH1A1HSD17B10MAPTHPGD

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-20070287706-A1 Certain substituted quinolones, compositions, and uses thereof AGRIUS GROUP, LLC. 2007-12-13 US claimed
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 2403/4885ALDH1A1 1055/4885HSD17B10 1580/4885

“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.