SCHEMBL13423231

SCHEMBL13423231

O=C(c1ccccc1)c1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1c-2c2c(c3c1-c1ccc(C(=O)c4ccccc4)cc1C31c3ccccc3-c3ccccc31)C1(c3ccccc3-c3ccccc31)c1cc(C(=O)c3ccccc3)ccc1-2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 5/20 0.56
▸ ATM Q13315 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ CNR2 P34972 1/20 0.41
▸ PBRM1 Q86U86 1/20 0.41
▸ PTPRC P08575 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP2C8 P10632 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ SRD5A2 P31213 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ ELANE P08246 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
SCHEMBL13423252 0.97 PDK2 (0.58) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL13423257 0.97 PDK2 (0.58) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL13423232 0.97 PDK2 (0.58) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL13423246 0.96 PDK2 (0.57) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL13423239 0.94 PDK2 (0.48) PDK2ATMTDP1L3MBTL1
SCHEMBL13423240 0.91 PDK2 (0.50) PDK2ATMTDP1L3MBTL1
SCHEMBL1552743 0.87 PDK2 (0.66) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL133477 0.87 PDK2 (0.66) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL14096679 0.86 PDK2 (0.50) PDK2ATMTDP1L3MBTL1CNR2
SCHEMBL13423313 0.84 PDK2 (0.48) PDK2L3MBTL1CNR2ALDH1A1SRD5A2

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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