SCHEMBL4384151

SCHEMBL4384151

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

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.42
HK2 P52789 1/20 0.39
TP53 P04637 1/20 0.38
KDM4E B2RXH2 5/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PADI4 Q9UM07 1/20 0.33
PTPN1 P18031 1/20 0.33
DHODH Q02127 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
SCHEMBL4386937 0.94 EGFR (0.40) EGFRHK2TP53KDM4EL3MBTL1
SCHEMBL4381699 0.93 EGFR (0.44) EGFRHK2TP53KDM4EMEN1
SCHEMBL4381558 0.91 EGFR (0.45) EGFRTP53KDM4EL3MBTL1SMN1; SMN2
SCHEMBL4386770 0.89 LMNA (0.41) EGFRTP53KDM4EL3MBTL1SMN1; SMN2
SCHEMBL2867378 0.89 EGFR (0.44) EGFRTP53KDM4EL3MBTL1GAA
SCHEMBL4381785 0.89 ALDH1A1 (0.37) EGFRALDH1A1PTPN1
SCHEMBL4379802 0.89 KDR (0.36) EGFRHK2PTPN1
SCHEMBL4387688 0.88 EGFR (0.43) EGFRHK2TP53KDM4EL3MBTL1
SCHEMBL4384182 0.88 EGFR (0.40) EGFRTP53KDM4EL3MBTL1SMN1; SMN2
SCHEMBL4383654 0.88 NPC1 (0.38) TP53SMN1; SMN2TSHRALDH1A1LMNA

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 624/4885HK2 4850/4885TP53 918/4885

“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.