SCHEMBL7127467

SCHEMBL7127467

COC(=O)Cc1cc2ccc(OCCNC(=N)N)cc2[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 12/20 0.48
HSD17B10 Q99714 11/20 0.48
MAPT P10636 4/20 0.48
TP53 P04637 1/20 0.48
ALOX15 P16050 1/20 0.48
ALDH1A1 P00352 8/20 0.48
TSHR P16473 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
CYP1A2 P05177 1/20 0.46
HPGD P15428 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KMT2A Q03164 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MTNR1A P48039 1/20 0.43
MTNR1B P49286 1/20 0.43
MEN1 O00255 2/20 0.42

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
SCHEMBL7075764 0.97 HSD17B10 (0.48) KDM4EHSD17B10MAPTTP53ALOX15
Trifluoroacetic Acid SCHEMBL7072029 0.94 HSD17B10 (0.46) KDM4EHSD17B10MAPTTP53ALOX15
SCHEMBL7071974 0.94 HSD17B10 (0.47) KDM4EHSD17B10MAPTTP53ALOX15
Trifluoroacetic Acid SCHEMBL7076632 0.92 HSD17B10 (0.45) KDM4EHSD17B10MAPTTP53ALOX15
SCHEMBL7073545 0.90 HSD17B10 (0.52) KDM4EHSD17B10MAPTTP53ALOX15
SCHEMBL7073531 0.90 HSD17B10 (0.45) KDM4EHSD17B10MAPTTP53ALOX15
SCHEMBL7075479 0.85 HSD17B10 (0.42) KDM4EHSD17B10MAPTTP53ALOX15
SCHEMBL7073444 0.84 KDM4E (0.51) KDM4EHSD17B10MAPTTP53ALOX15
Hydrochloric Acid SCHEMBL7074024 0.83 MTNR1A (0.43) KDM4EHSD17B10MAPTTP53ALOX15
Trifluoroacetic Acid SCHEMBL7075468 0.82 HSD17B10 (0.43) KDM4EHSD17B10MAPTTP53ALOX15

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-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin WYETH (US) 2003-06-12 US disclosed
US-6429214-B1 INHIBITORS OF BONE RESORPTION WYETH 2002-08-06 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-20030109523-A1 Bicyclic antagonists selective for the alphavbeta3 integrin ITGAV, ITGB2, ITGB3 KDM4E 560/4885HSD17B10 3835/4885MAPT 4836/4885

“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.