SCHEMBL824181

SCHEMBL824181

OC1(c2ccccc2-c2ccccc2)c2ccccc2C(O)(c2ccccc2-c2ccccc2)c2cc(Cl)ccc21

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 12/20 0.47
▸ CYP2A6 P11509 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ PTGDR2 Q9Y5Y4 1/20 0.38
▸ SLC6A3 Q01959 2/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ AKR1A1 P14550 1/20 0.37
▸ AKR1B1 P15121 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36

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
SCHEMBL19152841 0.90 PDK2 (0.55) PDK2CYP2A6THRBTDP1PTGDR2
SCHEMBL31497073 0.83 PDK2 (0.46) PDK2SLC6A3AKR1A1AKR1B1
SCHEMBL22891352 0.82 PDK2 (0.41) PDK2
SCHEMBL22933916 0.82 PDK2 (0.41) PDK2TDP1
SCHEMBL19797279 0.82 PDK2 (0.51) PDK2CYP2A6THRBTDP1AKR1A1
SCHEMBL24028216 0.82 PDK2 (0.41) PDK2PTGDR2SLC6A3SLC6A2SLC6A4
SCHEMBL22797538 0.82 PDK2 (0.47) PDK2SLC6A3SLC6A4CYP1A2
SCHEMBL761313 0.80 PDK2 (0.47) PDK2THRBTDP1PTGDR2SLC6A3
SCHEMBL490501 0.80 PDK2 (0.47) PDK2THRBTDP1PTGDR2SLC6A3
SCHEMBL13355857 0.80 PDK2 (0.47) PDK2THRBTDP1PTGDR2SLC6A3

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-8143781-B2 Organic electroluminescent compounds with high efficiency and display device using the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-27 — — US disclosed
US-8143781-B2 Organic electroluminescent compounds with high efficiency and display device using the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-27 — — US disclosed
US-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2011-05-12 — — US disclosed
US-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2011-05-12 — — US disclosed
WO-2009066803-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2009-05-28 — — WO 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-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME EED, EPHA4, NECTIN4 PDK2 2271/4885CYP2A6 4117/4885THRB 4718/4885

“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.

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