SCHEMBL13423239

SCHEMBL13423239

O=C(c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1ccccc1-2)c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1c-2c2c(c3c1-c1ccc(C(=O)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)cc1C31c3ccccc3-c3ccccc31)C1(c3ccccc3-c3ccccc31)c1cc(C(=O)c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3ccccc3-4)ccc1-2

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 16/20 0.48
▸ ATM Q13315 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HTR7 P34969 3/20 0.35
▸ HTR2B P41595 3/20 0.35

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
SCHEMBL13423240 0.97 PDK2 (0.50) PDK2ATMTDP1L3MBTL1HTR7
SCHEMBL13423231 0.94 PDK2 (0.56) PDK2ATMTDP1L3MBTL1
SCHEMBL13423257 0.91 PDK2 (0.58) PDK2ATMTDP1L3MBTL1
SCHEMBL13423232 0.91 PDK2 (0.58) PDK2ATMTDP1L3MBTL1
SCHEMBL13423252 0.91 PDK2 (0.58) PDK2ATMTDP1L3MBTL1
SCHEMBL13423246 0.90 PDK2 (0.57) PDK2ATMTDP1L3MBTL1
SCHEMBL22175362 0.88 PDK2 (0.50) PDK2ATMTDP1L3MBTL1HTR7
SCHEMBL134285 0.87 PDK2 (0.58) PDK2ATMTDP1L3MBTL1
SCHEMBL29114 0.87 PDK2 (0.58) PDK2ATMTDP1L3MBTL1
SCHEMBL134286 0.87 PDK2 (0.58) PDK2ATMTDP1L3MBTL1

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-7683229-B2 truxene and isotruxene derivatives, in particular spirotruxene and spiroisotruxene derivatives; use thereof in organic electronic devices, in particular organic electroluminescent devices MERCK PATENT GMBH (DE) 2010-03-23 — — US disclosed
US-20080093980-A1 Organic Electroluminescent Device MERCK PATENT GMBH (DE) 2008-04-24 — — 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-20080093980-A1 Organic Electroluminescent Device OXER1, NR3C2, OXTR PDK2 921/4885ATM 2905/4885TDP1 2511/4885

“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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