SCHEMBL6860153

SCHEMBL6860153

CC[Si](CC)(CC)OC1C(=O)N(C(=O)OCCOC)C1c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.47
GAA P10253 3/20 0.40
TSHR P16473 2/20 0.39
TP53 P04637 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
LIPE Q05469 1/20 0.35
POLB P06746 3/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MDM2 Q00987 1/20 0.35
USP2 O75604 1/20 0.34
PDE1C Q14123 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6860155 1.00 ELANE (0.47) ELANEGAATSHRTP53ADORA3
SCHEMBL6860152 1.00 ELANE (0.47) ELANEGAATSHRTP53ADORA3
SCHEMBL5743190 0.89 ELANE (0.49) ELANEGAATSHRTP53ADORA3
SCHEMBL5743179 0.89 ELANE (0.49) ELANEGAATSHRTP53ADORA3
SCHEMBL5743187 0.89 ELANE (0.49) ELANEGAATSHRTP53ADORA3
SCHEMBL6853219 0.89 ELANE (0.44) ELANETSHRTP53LMNAKDM4E
SCHEMBL6853215 0.89 ELANE (0.44) ELANETSHRTP53LMNAKDM4E
SCHEMBL6853211 0.89 ELANE (0.44) ELANETSHRTP53LMNAKDM4E
SCHEMBL6402276 0.89 ELANE (0.44) ELANETSHRTP53LMNAKDM4E
SCHEMBL9037293 0.87 ELANE (0.52) ELANEGAAADORA3LMNANPSR1

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-6794523-B2 ANTICANCER AGENTS, ANTITUMOR AGENTS; LEUKEMIA FLORIDA STATE UNIVERSITY 2004-09-21 US disclosed
US-20030065200-A1 Anticancer agents, antitumor agents; leukemia FLORIDA STATE UNIVERSITY 2003-04-03 US disclosed
US-6018073-A Tricyclic taxanes having an alkoxy, alkenoxy or aryloxy substituted side-chain and pharmaceutical compositions containing them FLORIDA STATE UNIVERSITY (US) 2000-01-25 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-20030065200-A1 Anticancer agents, antitumor agents; leukemia MCL1, BCL3, TOP2A ELANE 671/4885GAA 716/4885TSHR 3453/4885

“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.