SCHEMBL13828488

SCHEMBL13828488

COC(=O)c1cc(C2(c3ccc(OC)c(COC=O)c3)c3cc(C)ccc3-c3ccc(C)cc32)ccc1OC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.38
HSP90AA1 P07900 2/20 0.38
MAPT P10636 2/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
EGFR P00533 1/20 0.36
ALDH1A1 P00352 7/20 0.35
CYP2C9 P11712 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
LMNA P02545 2/20 0.35
CYP2D6 P10635 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
CYP46A1 Q9Y6A2 1/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL13400898 0.86 HSP90AA1 (0.44) HSP90AA1MAPTHTTNPSR1EGFR
SCHEMBL12440922 0.85 FFAR4 (0.36) SRCMAPTHTTALDH1A1CYP2C9
SCHEMBL14929049 0.83 ALDH1A1 (0.41) SRCHSP90AA1MAPTHTTNPSR1
SCHEMBL14928847 0.83 HSP90AA1 (0.37) SRCHSP90AA1MAPTHTTNPSR1
SCHEMBL14928875 0.82 SRC (0.31) SRC
SCHEMBL10348965 0.79
SCHEMBL12374344 0.78 LMNA (0.42) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL10348418 0.77 ALDH1A1 (0.35) HSP90AA1MAPTHTTNPSR1ALDH1A1
SCHEMBL13494976 0.75 ALDH1A1 (0.41) MAPTALDH1A1CYP2D6KMT2AMEN1
SCHEMBL13400901 0.74 KDM4E (0.48) HSP90AA1MAPTHTTNPSR1ALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8779137-B2 Compound and organic electroluminescent element using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-07-15 US disclosed
US-20120286654-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-15 US 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-20120286654-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING THE SAME ETV6, RPL19, LEF1 SRC 2006/4885HSP90AA1 4808/4885MAPT 4449/4885

“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.