SCHEMBL4385956

SCHEMBL4385956

COC(=O)Oc1cc(OC(=O)OC)c(-c2ccccc2)c(C(C(C)=O)C(=O)OC)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
HPGD P15428 1/20 0.40
HSD17B10 Q99714 1/20 0.40
BACE1 P56817 2/20 0.35
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
KMT2A Q03164 1/20 0.34
RAB9A P51151 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HK2 P52789 1/20 0.32
HCRTR1 O43613 1/20 0.32
MAPT P10636 1/20 0.32
S1PR1 P21453 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
KLK7 P49862 1/20 0.31

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
SCHEMBL4392467 0.89 HSP90AA1 (0.40) KDM4EHPGDHSD17B10ALDH1A1RAB9A
SCHEMBL4388446 0.80 EGFR (0.40) RAB9A
SCHEMBL4380779 0.76 TDP1 (0.42) KDM4EHPGDHSD17B10ALDH1A1LMNA
SCHEMBL4394066 0.74 PDE4B (0.40) BACE1PDE4APDE4BPDE4CPDE4D
SCHEMBL4381894 0.71 MTNR1A (0.42) KDM4EHPGDHSD17B10ALDH1A1NPSR1
SCHEMBL4380826 0.70 CAPN1 (0.38) BACE1ALDH1A1RAB9AMAPT
SCHEMBL27598322 0.68 ALDH1A1 (0.49) KDM4EALDH1A1KMT2ANPSR1
SCHEMBL2058536 0.66 GAA (0.55) KDM4EHPGDHSD17B10ALDH1A1LMNA
SCHEMBL11031397 0.66 KMT2A (0.62) HPGDALDH1A1LMNAKMT2A
SCHEMBL4391759 0.65 HDAC4 (0.43) KDM4EHPGDHSD17B10ALDH1A1RAB9A

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 3223/4885HPGD 3238/4885HSD17B10 405/4885

“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.