SCHEMBL4378339

SCHEMBL4378339

COC(=O)C(C=O)c1cc(O)cc(O)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
PDE4B Q07343 5/20 0.39
PDE4A P27815 4/20 0.39
PDE4C Q08493 4/20 0.39
PDE4D Q08499 4/20 0.39
MEN1 O00255 2/20 0.37
MAPT P10636 1/20 0.37
KCNA3 P22001 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CNR2 P34972 1/20 0.37
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36
LMNA P02545 1/20 0.36
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 1/20 0.36
HSP90AA1 P07900 1/20 0.36
ABCB1 P08183 1/20 0.36
MIF P14174 1/20 0.36
ESR1 P03372 2/20 0.35
ESR2 Q92731 2/20 0.35

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
SCHEMBL4387624 0.81 PDE4B (0.41) KMT2APDE4BPDE4APDE4CPDE4D
SCHEMBL4379804 0.81 PDE4B (0.41) KMT2APDE4BPDE4APDE4CPDE4D
SCHEMBL4394066 0.80 PDE4B (0.40) KMT2APDE4BPDE4APDE4CPDE4D
SCHEMBL4386663 0.80 ESR1 (0.47) KMT2AMEN1MDM4MDM2ALDH1A1
SCHEMBL4380947 0.79 CNR2 (0.42) KMT2APDE4BPDE4APDE4CPDE4D
SCHEMBL4388415 0.70 LMNA (0.44) KMT2AMEN1MAPTNPSR1LMNA
SCHEMBL2596959 0.70 KMT2A (0.66) KMT2AMEN1LMNAALDH1A1
SCHEMBL4380226 0.70 ESR1 (0.41) KMT2APDE4BPDE4APDE4CPDE4D
SCHEMBL8464873 0.69 KMT2A (0.46) KMT2AMEN1NPSR1ALDH1A1ESR1
SCHEMBL2559963 0.69 CYP2C19 (0.47) KMT2AMEN1ALDH1A1

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 KMT2A 3994/4885PDE4B 4266/4885PDE4A 4374/4885

“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.