SCHEMBL16852547

SCHEMBL16852547

CC1(c2ccccc2)c2ccccc2-c2ccc(N3c4ccc(-c5ccccc5)cc4Oc4cc(-c5ccccc5)ccc43)cc21

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 5/20 0.35
HSD11B1 P28845 1/20 0.30
PGR P06401 1/20 0.30

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
SCHEMBL13827419 0.87 PDK2 (0.39) PDK2PGR
SCHEMBL13827406 0.85 PDK2 (0.37) PDK2PGR
SCHEMBL16852554 0.85 PDK2 (0.34) PDK2
SCHEMBL16852553 0.84 PDK2 (0.34) PDK2
SCHEMBL808007 0.84 PDK2 (0.39) PDK2
SCHEMBL13827556 0.83 PDK2 (0.39) PDK2PGR
SCHEMBL18542369 0.82 PGR (0.34) PDK2PGR
SCHEMBL18544766 0.82 PDK2 (0.40) PDK2PGR
SCHEMBL18544764 0.82 PGR (0.35) PDK2PGR
SCHEMBL16852525 0.81 TYMS (0.32) PDK2HSD11B1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9595681-B2 Compounds and organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-03-14 US disclosed
US-9595681-B2 Compounds and organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-03-14 US disclosed
EP-2875092-B1 COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-02-15 EP disclosed
US-20150179953-A1 COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-06-25 US disclosed
US-20150179953-A1 COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-06-25 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-20150179953-A1 COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICES AFF2, ETV6, PEF1 PDK2 1521/4885HSD11B1 3576/4885PGR 2575/4885

“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.