SCHEMBL4384178

SCHEMBL4384178

COCCc1c(CC(C)=O)c(OCOC)cc(OCOC)c1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.42
TP53 P04637 1/20 0.36
KDM4E B2RXH2 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PTPN1 P18031 1/20 0.33
TSHR P16473 1/20 0.33
CYP3A4 P08684 1/20 0.33
DHODH Q02127 1/20 0.32
CAPN1 P07384 1/20 0.32
CLCN2 P51788 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32

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
SCHEMBL4384151 0.85 EGFR (0.42) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4379642 0.85 EGFR (0.37) EGFRTP53KDM4ECLCN2
SCHEMBL4381558 0.84 EGFR (0.45) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4387376 0.84 EGFR (0.43) EGFRKDM4EL3MBTL1MEN1KMT2A
SCHEMBL4381322 0.82 EGFR (0.40) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL2867378 0.82 EGFR (0.44) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4386770 0.82 LMNA (0.41) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4384182 0.81 EGFR (0.40) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4395195 0.80 EGFR (0.40) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4386937 0.80 EGFR (0.40) EGFRTP53KDM4EL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P EGFR 624/4885TP53 918/4885KDM4E 3223/4885

“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.