SCHEMBL4386489

SCHEMBL4386489

COC(=O)Cc1cc(O)cc(O)c1-c1cccc2c1oc1ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.54
ALOX5 P09917 3/20 0.51
HDAC8 Q9BY41 3/20 0.44
ALDH1A1 P00352 5/20 0.41
GLA P06280 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 3/20 0.40
ESR2 Q92731 1/20 0.39
MAPT P10636 2/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 1/20 0.38
GGPS1 O95749 1/20 0.37
EGFR P00533 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL4385995 0.82 ATM (0.43) KDM4EHDAC8MAPTKMT2AEGFR
SCHEMBL4382797 0.77 TTR (0.46) KDM4EALDH1A1GAAHPGDESR2
SCHEMBL4384090 0.77 VEGFA (0.44) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL4388539 0.73 HSP90AB1 (0.46) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL4386486 0.71 ACLY (0.47) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL4554338 0.70 ALOX5 (0.50) KDM4EALOX5HDAC8ALDH1A1HPGD
SCHEMBL4384857 0.69 EGFR (0.42) KDM4EALDH1A1GLAGAAHPGD
SCHEMBL17917527 0.69 MAPT (0.46) KDM4EALOX5HDAC8ALDH1A1HPGD
SCHEMBL312120 0.69 TNKS (0.53) KDM4EALOX5ALDH1A1GAAHPGD
SCHEMBL6025217 0.69 CCNC (0.45) ALOX5ALDH1A1ESR2EGFR

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 KDM4E 3223/4885ALOX5 4819/4885HDAC8 94/4885

“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.