SCHEMBL4386409

SCHEMBL4386409

COCOc1cc(CC(=O)OC)c(-c2ccccc2OC)c(OCOC)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
VDR P11473 1/20 0.39
RXRA P19793 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
ESR2 Q92731 1/20 0.39
CHEK1 O14757 1/20 0.39
AURKA O14965 1/20 0.39
DAPK3 O43293 1/20 0.39
JAK2 O60674 1/20 0.39
ABL1 P00519 1/20 0.39
NTRK1 P04629 1/20 0.39
FYN P06241 1/20 0.39
CSF1R P07333 1/20 0.39
RET P07949 1/20 0.39
IGF1R P08069 1/20 0.39
MET P08581 1/20 0.39

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
SCHEMBL4394443 0.87 PDK2 (0.39) CHEK1AURKADAPK3JAK2ABL1
SCHEMBL4386175 0.85 L3MBTL1 (0.40) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL2866502 0.84 EGFR (0.43) THRBALDH1A1KDM4EHPGDRAB9A
SCHEMBL4384140 0.82 EGFR (0.46) THRBALDH1A1KDM4ERAB9AKMT2A
SCHEMBL4390545 0.81 ROR1 (0.43) ALDH1A1KDM4EHPGDHSD17B10TSHR
SCHEMBL4388923 0.81 CCNC (0.41) PPARGCDK8HTTEGFR
SCHEMBL4386004 0.81 P2RX3 (0.36) THRBALDH1A1KDM4EHPGDRAB9A
SCHEMBL4386691 0.80 KDM4E (0.48) ALDH1A1KDM4EHPGDRAB9AHSD17B10
SCHEMBL4386233 0.80 EGFR (0.39) PPARGPPARDPPARAMAPK8CAMK2A
SCHEMBL4382066 0.78 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDHSD17B10KMT2A

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 ESR1 610/4885THRA 1288/4885THRB 1046/4885

“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.